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ChEMBL ligand: CHEMBL865 (Bextra, NSC-759846, SC-65872, Valdecoxib, Valdyn) |
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DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
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AGAP002992-PA in Anopheles gambiae (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3399914] [UniProtKB: Q5TU56] | ||||||||
ChEMBL | Inhibition of Anopheles gambiae carbonic anhydrase pre-incubated for 15 mins by stopped-flow CO2 hydration assay | B | 6.79 | pKi | 164 | nM | Ki | Bioorg Med Chem (2015) 23: 2303-2309 [PMID:25882523] |
Alpha carbonic anhydrase in Stylophora pistillata (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1075028] [UniProtKB: B5SU02] | ||||||||
ChEMBL | Inhibition of cloned Stylophora pistillata alpha-CA expressed in human HEK293 cells by stopped-flow CO2 assay | B | 7.54 | pKi | 28.7 | nM | Ki | Bioorg Med Chem (2009) 17: 5054-5058 [PMID:19520577] |
ChEMBL | Inhibition of Stylophora pistillata carbonic anhydrase by stopped-flow CO2 hydration assay | B | 7.54 | pKi | 28.7 | nM | Ki | Bioorg Med Chem Lett (2011) 21: 710-714 [PMID:21208801] |
Astrosclerin-3 in Astrosclera willeyana (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1944499] [UniProtKB: A6YCJ1] | ||||||||
ChEMBL | Inhibition of GST-tagged astrosclera willeyana Astrosclerin-3 expressed in Escherichia coli after 15 mins preincubation by stopped flow CO2 hydration assay | B | 6.29 | pKi | 517 | nM | Ki | Bioorg Med Chem (2012) 20: 1403-1410 [PMID:22285172] |
Carbonate dehydratase in Sulfurihydrogenibium sp. (strain YO3AOP1) (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3745586] [UniProtKB: B2V8E3] | ||||||||
ChEMBL | Inhibition of recombinant Sulfurihydrogenibium yellowstonense YO3AOP1 carbonic anhydrase by stopped flow CO2 hydrase assay | B | 8.28 | pKi | 5.3 | nM | Ki | Bioorg Med Chem Lett (2016) 26: 401-405 [PMID:26691758] |
Carbonic anhydrase in Mycobacterium tuberculosis (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL6068] [UniProtKB: P9WPJ9] | ||||||||
ChEMBL | Inhibition of full length Mycobacterium tuberculosis H37Rv recombinant carbonic anhydrase 2 encoded by RV3588c by stopped flow CO2 hydration assay | B | 6.17 | pKi | 682 | nM | Ki | Bioorg Med Chem Lett (2009) 19: 6649-6654 [PMID:19846301] |
ChEMBL | Inhibition of Mycobacterium tuberculosis recombinant carbonic anhydrase Rv3588c pre-incubated for 15 mins by stopped-flow CO2 hydration method | B | 6.17 | pKi | 682 | nM | Ki | J Med Chem (2012) 55: 9619-9629 [PMID:23067387] |
Carbonic anhydrase in Methanosarcina thermophila (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3932] [UniProtKB: P40881] | ||||||||
ChEMBL | Inhibitory activity against alpha carbonic anhydrase (Co-Cam) from Methanosarcina thermophila | B | 6.62 | pKi | 240 | nM | Ki | Bioorg Med Chem Lett (2004) 14: 6001-6006 [PMID:15546717] |
ChEMBL | Inhibitory activity against alpha carbonic anhydrase (Zn-Cam) from Methanosarcina thermophila | B | 6.89 | pKi | 130 | nM | Ki | Bioorg Med Chem Lett (2004) 14: 6001-6006 [PMID:15546717] |
Carbonic anhydrase in Stylophora pistillata (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1649055] [UniProtKB: C0IX24] | ||||||||
ChEMBL | Inhibition of Stylophora pistillata carbonic anhydrase 2 by stopped-flow CO2 hydration assay | B | 5.24 | pKi | 5710 | nM | Ki | Bioorg Med Chem Lett (2011) 21: 710-714 [PMID:21208801] |
Carbonic anhydrase in Methanobacterium thermoautotrophicum (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3926] [UniProtKB: Q50565] | ||||||||
ChEMBL | Inhibitory activity against beta carbonic anhydrase (Cab) from Methanobacterium thermoautotrophicum | B | 4.21 | pKi | 61000 | nM | Ki | Bioorg Med Chem Lett (2004) 14: 6001-6006 [PMID:15546717] |
Carbonic anhydrase in Candida albicans (strain SC5314 / ATCC MYA-2876) (Yeast) (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5337] [UniProtKB: Q5AJ71] | ||||||||
ChEMBL | Inhibition of Candida albicans recombinant Nce103 by stopped-flow CO2 hydration assay | B | 6.16 | pKi | 699 | nM | Ki | Bioorg Med Chem (2009) 17: 4503-4509 [PMID:19450983] |
ChEMBL | Inhibition of Candida albicans CaNce103 preincubated for 15 mins measured for 10 to 100 sec by stopped-flow method | B | 6.16 | pKi | 699 | nM | Ki | J Med Chem (2012) 55: 3513-3520 [PMID:22424239] |
Carbonic anhydrase in Candida glabrata CBS 138 (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL6185] [UniProtKB: Q6FTL6] | ||||||||
ChEMBL | Inhibition of recombinant full length Candida glabrata NCE103 expressed in Escherichia coli BL21 preincubated for 15 mins by stopped-flow CO2 hydrase assay | B | 7.01 | pKi | 97 | nM | Ki | Bioorg Med Chem Lett (2013) 23: 2647-2652 [PMID:23511020] |
Carbonic anhydrase in Saccharomyces cerevisiae S288c (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5931] [UniProtKB: P53615] | ||||||||
ChEMBL | Inhibition of Saccharomyces cerevisiae recombinant CA expressed in Escherichia coli by stopped-flow CO2 hydrase assay | B | 6.18 | pKi | 654 | nM | Ki | Bioorg Med Chem (2009) 17: 1158-1163 [PMID:19124253] |
Carbonic anhydrase 15 in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5973] [UniProtKB: Q99N23] | ||||||||
ChEMBL | Inhibition of mouse recombinant carbonic anhydrase 15 by stopped flow CO2 hydrase assay | B | 7.18 | pKi | 66 | nM | Ki | J Med Chem (2009) 52: 646-654 [PMID:19193158] |
Carbonic anhydrase 2 in Cryptococcus neoformans var. grubii (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1697676] [UniProtKB: Q3I4V7] | ||||||||
ChEMBL | Inhibition of Cryptococcus neoformans Can2 preincubated for 15 mins measured for 10 to 100 sec by stopped-flow method | B | 6.15 | pKi | 704 | nM | Ki | J Med Chem (2012) 55: 3513-3520 [PMID:22424239] |
Carbonic anhydrase, alpha family in Thiomicrospira crunogena (strain XCL-2) (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3621035] [UniProtKB: Q31FD6] | ||||||||
ChEMBL | Inhibition of recombinant Thiomicrospira crunogena XCL-2 carbonic anhydrase by stopped flow CO2 hydrase assay | B | 6.28 | pKi | 529 | nM | Ki | Bioorg Med Chem Lett (2016) 26: 401-405 [PMID:26691758] |
carbonic anhydrase 1/Carbonic anhydrase I in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL261] [GtoPdb: 2597] [UniProtKB: P00915] | ||||||||
ChEMBL | Inhibition of full length human cytosolic carbonic anhydrase 1 preincubated for 15 mins by stop flow CO2 hydrase assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem Lett (2016) 26: 4184-4190 [PMID:27485387] |
ChEMBL | Inhibitory activity against human carbonic anhydrase I (hCAI) | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem Lett (2005) 15: 1149-1154 [PMID:15686931] |
ChEMBL | Inhibitory activity against human carbonic anhydrase I at 0.09 uM | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem Lett (2004) 14: 6001-6006 [PMID:15546717] |
ChEMBL | Inhibitory activity against cloned human CA1 | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem Lett (2006) 16: 437-442 [PMID:16290146] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method | B | 4.27 | pKi | 54000 | nM | Ki | J Med Chem (2009) 52: 2226-2232 [PMID:19317447] |
ChEMBL | Inhibition of human recombinant CA1 by stopped-flow CO2 hydrase assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem (2009) 17: 1158-1163 [PMID:19124253] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydrase assay | B | 4.27 | pKi | 54000 | nM | Ki | J Med Chem (2009) 52: 646-654 [PMID:19193158] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration assay | B | 4.27 | pKi | 54000 | nM | Ki | J Med Chem (2009) 52: 3116-3120 [PMID:19338333] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 1 by stopped-flow CO2 hydrase method | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem (2009) 17: 4503-4509 [PMID:19450983] |
ChEMBL | Inhibition of human recombinant CA1 by stopped-flow CO2 assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem (2009) 17: 5054-5058 [PMID:19520577] |
ChEMBL | Inhibition of human recombinant CA1 by stopped-flow CO2 hydration assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem Lett (2011) 21: 710-714 [PMID:21208801] |
ChEMBL | Inhibition of human carbonic anhydrase I by spectrophotometry at pH 7.5 | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem (2011) 19: 1172-1178 [PMID:21251841] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 1 at pH 7.5 by stopped flow CO2 hydration assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem (2011) 19: 5023-5030 [PMID:21757360] |
ChEMBL | Inhibition of human carbonic anhydrase 1-catalyzed CO2 hydration activity by stopped flow assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem Lett (2011) 21: 5892-5896 [PMID:21852133] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 1 after 15 mins by stopped flow CO2 hydration assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem (2012) 20: 1403-1410 [PMID:22285172] |
ChEMBL | Inhibition of human recombinant full length CA1 pre-incubated for 15 mins by stopped-flow CO2 hydration method | B | 4.27 | pKi | 54000 | nM | Ki | J Med Chem (2012) 55: 9619-9629 [PMID:23067387] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 1 preincubated for 15 mins by stopped-flow CO2 hydrase assay | B | 4.27 | pKi | 54000 | nM | Ki | J Med Chem (2012) 55: 10742-10748 [PMID:23181552] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration assay | B | 4.27 | pKi | 54000 | nM | Ki | J Med Chem (2013) 56: 1761-1771 [PMID:23391336] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 1 preincubated for 15 mins by CO2 hydration stopped-flow assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem (2013) 21: 1534-1538 [PMID:22883029] |
ChEMBL | Inhibition of human cytosolic carbonic anhydrase 1 preincubated for 15 mins by stopped flow CO2 hydration assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem (2013) 21: 5168-5174 [PMID:23867389] |
ChEMBL | Inhibition of human cytosolic carbonic anhydrase 1 preincubated for 15 mins at room temperature followed by 72 hrs at 4 degC by stopped flow CO2 hydration assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem (2013) 21: 5973-5982 [PMID:23965175] |
ChEMBL | Inhibition of human cytosolic carbonic anhydrase 1 by stopped-flow CO2 hydration assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem (2014) 22: 1586-1595 [PMID:24513184] |
ChEMBL | Inhibition of human carbonic anhydrase-1 by stopped-flow CO2 hydration assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem (2014) 22: 2939-2946 [PMID:24792813] |
ChEMBL | Inhibition of human recombinant Carbonic anhydrase 1 compound preincubated for 15 mins by stopped flow CO2 hydrase assay method | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem (2014) 22: 4537-4543 [PMID:25129169] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 1 by stopped-flow CO2 hydration assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem (2015) 23: 526-531 [PMID:25533402] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydrase assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem (2015) 23: 1728-1734 [PMID:25773015] |
ChEMBL | Inhibition of human carbonic anhydrase 1 pre-incubated for 15 mins by stopped-flow CO2 hydration assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem (2015) 23: 2303-2309 [PMID:25882523] |
ChEMBL | Inhibition of human CA1 incubated for 15 mins prior to testing by stopped flow CO2 hydrase assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem Lett (2015) 25: 5485-5489 [PMID:26525863] |
ChEMBL | Inhibition of recombinant human carbonic anhydrase-1 by stopped flow CO2 hydrase assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem Lett (2016) 26: 401-405 [PMID:26691758] |
ChEMBL | Inhibition of human Carbonic anhydrase1 using CO2 as substrate preincubated for 15 mins by stopped-flow CO2 hydration assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem (2016) 24: 1115-1120 [PMID:26850377] |
ChEMBL | Inhibition of human carbonic anhydrase 1 incubated for 15 mins by stopped-flow CO2 hydration assay | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem Lett (2016) 26: 1821-1826 [PMID:26920803] |
ChEMBL | Inhibitory activity against human carbonic anhydrase I (hCA I) by using esterase assay method | B | 4.27 | pKi | 54000 | nM | Ki | Bioorg Med Chem Lett (2004) 14: 3757-3762 [PMID:15203157] |
ChEMBL | Inhibition of human carbonic anhydrase-1 assessed as reduction in CO2 hydration preincubated for 15 mins followed by CO2 addition measured for 10 to 100 secs by stopped-flow assay | B | 4.3 | pKi | >50000 | nM | Ki | Bioorg Med Chem (2017) 25: 3555-3561 [PMID:28511911] |
ChEMBL | Inhibition of recombinant human carbonic anhydrase 1 assessed as reduction in CO2 hydration preincubated for 15 mins followed by CO2 addition measured for 10 to 100 sec by Line-Weaver Burk plot analysis | B | 4.3 | pKi | >50000 | nM | Ki | Bioorg Med Chem Lett (2017) 27: 490-495 [PMID:28025002] |
ChEMBL | Inhibitory activity against human carbonic anhydrase I was determined | B | 4.27 | pIC50 | 54000 | nM | IC50 | J Med Chem (2004) 47: 550-557 [PMID:14736236] |
ChEMBL | Inhibitory activity of compound against human carbonic anhydrase I | F | 4.27 | pIC50 | 54000 | nM | IC50 | Bioorg Med Chem Lett (2004) 14: 337-341 [PMID:14698154] |
carbonic anhydrase 2/Carbonic anhydrase II in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL205] [GtoPdb: 3092] [UniProtKB: P00918] | ||||||||
ChEMBL | Inhibitory activity against human carbonic anhydrase II at 0.01 uM | B | 4.37 | pKi | 43000 | nM | Ki | Bioorg Med Chem Lett (2004) 14: 6001-6006 [PMID:15546717] |
ChEMBL | Inhibitory activity against human carbonic anhydrase II (hCAII) | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem Lett (2005) 15: 1149-1154 [PMID:15686931] |
ChEMBL | Inhibitory activity against cloned human CA2 | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem Lett (2006) 16: 437-442 [PMID:16290146] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method | B | 7.37 | pKi | 43 | nM | Ki | J Med Chem (2009) 52: 2226-2232 [PMID:19317447] |
ChEMBL | Inhibition of human recombinant CA2 by stopped-flow CO2 hydrase assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem (2009) 17: 1158-1163 [PMID:19124253] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydrase assay | B | 7.37 | pKi | 43 | nM | Ki | J Med Chem (2009) 52: 646-654 [PMID:19193158] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration assay | B | 7.37 | pKi | 43 | nM | Ki | J Med Chem (2009) 52: 3116-3120 [PMID:19338333] |
ChEMBL | Inhibition of Helicobacter pylori beta-carbonic anhydrase by stopped-flow CO2 hydration assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem (2009) 17: 4503-4509 [PMID:19450983] |
ChEMBL | Inhibition of human recombinant CA2 by stopped-flow CO2 assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem (2009) 17: 5054-5058 [PMID:19520577] |
ChEMBL | Inhibition of human recombinant CA2 by stopped-flow hydration assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem Lett (2009) 19: 6649-6654 [PMID:19846301] |
ChEMBL | Inhibition of human recombinant CA2 by stopped-flow CO2 hydration assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem Lett (2011) 21: 710-714 [PMID:21208801] |
ChEMBL | Inhibition of human carbonic anhydrase II by spectrophotometry at pH 7.5 | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem (2011) 19: 1172-1178 [PMID:21251841] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 2 at pH 7.5 by stopped flow CO2 hydration assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem (2011) 19: 5023-5030 [PMID:21757360] |
ChEMBL | Inhibition of human carbonic anhydrase 2-catalyzed CO2 hydration activity by stopped flow assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem Lett (2011) 21: 5892-5896 [PMID:21852133] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 2 after 15 mins by stopped flow CO2 hydration assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem (2012) 20: 1403-1410 [PMID:22285172] |
ChEMBL | Inhibition of human carbonic anhydrase 2 preincubated for 15 mins measured for 10 to 100 sec by stopped-flow method | B | 7.37 | pKi | 43 | nM | Ki | J Med Chem (2012) 55: 3513-3520 [PMID:22424239] |
ChEMBL | Inhibition of human recombinant full length CA2 pre-incubated for 15 mins by stopped-flow CO2 hydration method | B | 7.37 | pKi | 43 | nM | Ki | J Med Chem (2012) 55: 9619-9629 [PMID:23067387] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 2 preincubated for 15 mins by stopped-flow CO2 hydrase assay | B | 7.37 | pKi | 43 | nM | Ki | J Med Chem (2012) 55: 10742-10748 [PMID:23181552] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration assay | B | 7.37 | pKi | 43 | nM | Ki | J Med Chem (2013) 56: 1761-1771 [PMID:23391336] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 2 preincubated for 15 mins by CO2 hydration stopped-flow assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem (2013) 21: 1534-1538 [PMID:22883029] |
ChEMBL | Inhibition of human cytosolic carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem (2013) 21: 5168-5174 [PMID:23867389] |
ChEMBL | Inhibition of human cytosolic carbonic anhydrase 2 preincubated for 15 mins at room temperature followed by 72 hrs at 4 degC by stopped flow CO2 hydration assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem (2013) 21: 5973-5982 [PMID:23965175] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem Lett (2014) 24: 275-279 [PMID:24314394] |
ChEMBL | Inhibition of human cytosolic carbonic anhydrase 2 by stopped-flow CO2 hydration assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem (2014) 22: 1586-1595 [PMID:24513184] |
ChEMBL | Inhibition of human carbonic anhydrase-2 by stopped-flow CO2 hydration assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem (2014) 22: 2939-2946 [PMID:24792813] |
ChEMBL | Inhibition of human recombinant Carbonic anhydrase 2 compound preincubated for 15 mins by stopped flow CO2 hydrase assay method | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem (2014) 22: 4537-4543 [PMID:25129169] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 2 by stopped-flow CO2 hydration assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem (2015) 23: 526-531 [PMID:25533402] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydrase assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem (2015) 23: 1728-1734 [PMID:25773015] |
ChEMBL | Inhibition of human carbonic anhydrase 2 pre-incubated for 15 mins by stopped-flow CO2 hydration assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem (2015) 23: 2303-2309 [PMID:25882523] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase-2 by stopped flow CO2 hydrase assay method | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem Lett (2015) 25: 3550-3555 [PMID:26174556] |
ChEMBL | Inhibition of human CA2 incubated for 15 mins prior to testing by stopped flow CO2 hydrase assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem Lett (2015) 25: 5485-5489 [PMID:26525863] |
ChEMBL | Inhibition of recombinant human carbonic anhydrase-2 by stopped flow CO2 hydrase assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem Lett (2016) 26: 401-405 [PMID:26691758] |
ChEMBL | Inhibition of human Carbonic anhydrase2 using CO2 as substrate preincubated for 15 mins by stopped-flow CO2 hydration assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem (2016) 24: 1115-1120 [PMID:26850377] |
ChEMBL | Inhibition of human carbonic anhydrase 2 preincubated for 15 mins by CO2 hydrase stopped flow assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem Lett (2016) 26: 1253-1259 [PMID:26832216] |
ChEMBL | Inhibition of human carbonic anhydrase 2 incubated for 15 mins by stopped-flow CO2 hydration assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem Lett (2016) 26: 1821-1826 [PMID:26920803] |
ChEMBL | Inhibition of human carbonic anhydrase 2 assessed as reduction in CO2 hydration preincubated for 15 mins followed by CO2 addition measured for 10 to 100 sec by Line-Weaver Burk plot analysis | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem Lett (2017) 27: 490-495 [PMID:28025002] |
ChEMBL | Inhibition of human carbonic anhydrase-2 assessed as reduction in CO2 hydration preincubated for 15 mins followed by CO2 addition measured for 10 to 100 secs by stopped-flow assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem (2017) 25: 3555-3561 [PMID:28511911] |
ChEMBL | Inhibition of human cytosolic carbonic anhydrase 2 preincubated for 15 mins by stop flow CO2 hydrase assay | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem Lett (2016) 26: 4184-4190 [PMID:27485387] |
ChEMBL | Inhibitory activity against human carbonic anhydrase II (hCA II) by using esterase assay method | B | 7.37 | pKi | 43 | nM | Ki | Bioorg Med Chem Lett (2004) 14: 3757-3762 [PMID:15203157] |
ChEMBL | Binding affinity to human recombinant CA2 assessed as inhibition constant incubated for 15 mins prior to testing by phenol red based stopped-flow CO2 hydration assay | B | 7.37 | pKi | 43 | nM | Ki | Eur J Med Chem (2021) 209: 112923-112923 [PMID:33121862] |
ChEMBL | DRUGMATRIX: Carbonic Anhydrase II enzyme inhibition (substrate: 4-Nitrophenyl acetate (4-NPA)) | B | 5.34 | pIC50 | 4574 | nM | IC50 | DrugMatrix in vitro pharmacology data |
ChEMBL | Inhibitory activity against human carbonic anhydrase II was determined | B | 7.37 | pIC50 | 43 | nM | IC50 | J Med Chem (2004) 47: 550-557 [PMID:14736236] |
ChEMBL | Inhibitory activity of compound against human carbonic anhydrase II | F | 7.37 | pIC50 | 43 | nM | IC50 | Bioorg Med Chem Lett (2004) 14: 337-341 [PMID:14698154] |
Carbonic anhydrase III in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2885] [UniProtKB: P07451] | ||||||||
ChEMBL | Inhibition of human recombinant full length CA3 pre-incubated for 15 mins by stopped-flow CO2 hydration method | B | 4.11 | pKi | 78000 | nM | Ki | J Med Chem (2012) 55: 9619-9629 [PMID:23067387] |
carbonic anhydrase 4/Carbonic anhydrase IV in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3729] [GtoPdb: 2599] [UniProtKB: P22748] | ||||||||
ChEMBL | Inhibitory activity against human carbonic anhydrase IV (hCAIV) | B | 5.87 | pKi | 1340 | nM | Ki | Bioorg Med Chem Lett (2005) 15: 1149-1154 [PMID:15686931] |
ChEMBL | Inhibition of human recombinant full length CA4 pre-incubated for 15 mins by stopped-flow CO2 hydration method | B | 5.87 | pKi | 1340 | nM | Ki | J Med Chem (2012) 55: 9619-9629 [PMID:23067387] |
ChEMBL | Binding affinity to human recombinant CA4 assessed as inhibition constant incubated for 15 mins prior to testing by phenol red based stopped-flow CO2 hydration assay | B | 6.47 | pKi | 340 | nM | Ki | Eur J Med Chem (2021) 209: 112923-112923 [PMID:33121862] |
Carbonic anhydrase IV in Bovine (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL281] [UniProtKB: Q95323] | ||||||||
ChEMBL | Inhibitory activity against bovine carbonic anhydrase IV (bCAIV) | B | 6.47 | pKi | 340 | nM | Ki | Bioorg Med Chem Lett (2005) 15: 1149-1154 [PMID:15686931] |
ChEMBL | Inhibitory activity against CA4 isolated from bovine lung microsomes | B | 6.47 | pKi | 340 | nM | Ki | Bioorg Med Chem Lett (2006) 16: 437-442 [PMID:16290146] |
ChEMBL | Inhibitory activity against bovine carbonic anhydrase IV was determined | B | 6.47 | pIC50 | 340 | nM | IC50 | J Med Chem (2004) 47: 550-557 [PMID:14736236] |
ChEMBL | Inhibitory activity of compound against bovine carbonic anhydrase IV | F | 6.47 | pIC50 | 340 | nM | IC50 | Bioorg Med Chem Lett (2004) 14: 337-341 [PMID:14698154] |
carbonic anhydrase 9/Carbonic anhydrase IX in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3594] [GtoPdb: 3055] [UniProtKB: Q16790] | ||||||||
ChEMBL | Inhibitory activity against human carbonic anhydrase IX at 0.09 uM | B | 4.57 | pKi | 27000 | nM | Ki | Bioorg Med Chem Lett (2004) 14: 6001-6006 [PMID:15546717] |
ChEMBL | Inhibitory activity against cloned human CA9 | B | 7.57 | pKi | 27 | nM | Ki | Bioorg Med Chem Lett (2006) 16: 437-442 [PMID:16290146] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 9 catalytic domain by stopped flow CO2 hydrase assay | B | 7.57 | pKi | 27 | nM | Ki | J Med Chem (2009) 52: 646-654 [PMID:19193158] |
ChEMBL | Inhibition of human carbonic anhydrase 9-catalyzed CO2 hydration activity by stopped flow assay | B | 7.57 | pKi | 27 | nM | Ki | Bioorg Med Chem Lett (2011) 21: 5892-5896 [PMID:21852133] |
ChEMBL | Inhibition of human recombinant CA9 catalytic domain pre-incubated for 15 mins by stopped-flow CO2 hydration method | B | 7.57 | pKi | 27 | nM | Ki | J Med Chem (2012) 55: 9619-9629 [PMID:23067387] |
ChEMBL | Inhibition of human membrane bound carbonic anhydrase 9 preincubated for 15 mins at room temperature followed by 72 hrs at 4 degC by stopped flow CO2 hydration assay | B | 7.57 | pKi | 27 | nM | Ki | Bioorg Med Chem (2013) 21: 5973-5982 [PMID:23965175] |
ChEMBL | Inhibitory activity against human carbonic anhydrase IX (hCA IX) by using CO2 hydrase assay method | B | 7.57 | pKi | 27 | nM | Ki | Bioorg Med Chem Lett (2004) 14: 3757-3762 [PMID:15203157] |
ChEMBL | Inhibition of human transmembrane carbonic anhydrase 9 by stopped-flow CO2 hydration assay | B | 7.57 | pKi | 27 | nM | Ki | Bioorg Med Chem (2014) 22: 1586-1595 [PMID:24513184] |
ChEMBL | Inhibitory activity against human carbonic anhydrase IX was determined | B | 7.57 | pIC50 | 27 | nM | IC50 | J Med Chem (2004) 47: 550-557 [PMID:14736236] |
carbonic anhydrase 5A/Carbonic anhydrase VA in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4789] [GtoPdb: 3093] [UniProtKB: P35218] | ||||||||
ChEMBL | Inhibition of human recombinant full length CA5A pre-incubated for 15 mins by stopped-flow CO2 hydration method | B | 6.04 | pKi | 912 | nM | Ki | J Med Chem (2012) 55: 9619-9629 [PMID:23067387] |
Carbonic anhydrase VB in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3969] [UniProtKB: Q9Y2D0] | ||||||||
ChEMBL | Inhibition of human recombinant full length CA5B pre-incubated for 15 mins by stopped-flow CO2 hydration method | B | 7.06 | pKi | 88 | nM | Ki | J Med Chem (2012) 55: 9619-9629 [PMID:23067387] |
Carbonic anhydrase VI in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3025] [UniProtKB: P23280] | ||||||||
ChEMBL | Inhibition of human full length recombinant carbonic anhydrase 6 by stopped flow CO2 hydrase assay | B | 6.24 | pKi | 572 | nM | Ki | J Med Chem (2009) 52: 646-654 [PMID:19193158] |
ChEMBL | Inhibition of human recombinant full length CA6 pre-incubated for 15 mins by stopped-flow CO2 hydration method | B | 6.24 | pKi | 572 | nM | Ki | J Med Chem (2012) 55: 9619-9629 [PMID:23067387] |
carbonic anhydrase 7/Carbonic anhydrase VII in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2326] [GtoPdb: 2749] [UniProtKB: P43166] | ||||||||
ChEMBL | Inhibition of human recombinant full length CA7 pre-incubated for 15 mins by stopped-flow CO2 hydration method | B | 5.41 | pKi | 3900 | nM | Ki | J Med Chem (2012) 55: 9619-9629 [PMID:23067387] |
ChEMBL | Inhibition of human cytosolic carbonic anhydrase 7 preincubated for 15 mins by stopped flow CO2 hydration assay | B | 5.41 | pKi | 3900 | nM | Ki | Bioorg Med Chem (2013) 21: 5168-5174 [PMID:23867389] |
ChEMBL | Inhibition of human cytosolic carbonic anhydrase 7 preincubated for 15 mins at room temperature followed by 72 hrs at 4 degC by stopped flow CO2 hydration assay | B | 5.41 | pKi | 3900 | nM | Ki | Bioorg Med Chem (2013) 21: 5973-5982 [PMID:23965175] |
ChEMBL | Inhibition of human recombinant carbonic anhydrase 7 preincubated for 15 mins by stopped flow CO2 hydration assay | B | 5.41 | pKi | 3900 | nM | Ki | Eur J Med Chem (2014) 71: 105-111 [PMID:24287559] |
carbonic anhydrase 12/Carbonic anhydrase XII in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3242] [GtoPdb: 2747] [UniProtKB: O43570] | ||||||||
ChEMBL | Inhibitory activity against cloned human CA12 | B | 7.89 | pKi | 13 | nM | Ki | Bioorg Med Chem Lett (2006) 16: 437-442 [PMID:16290146] |
ChEMBL | Inhibition of human carbonic anhydrase 12-catalyzed CO2 hydration activity by stopped flow assay | B | 7.89 | pKi | 13 | nM | Ki | Bioorg Med Chem Lett (2011) 21: 5892-5896 [PMID:21852133] |
ChEMBL | Inhibition of human recombinant CA12 catalytic domain pre-incubated for 15 mins by stopped-flow CO2 hydration method | B | 7.89 | pKi | 13 | nM | Ki | J Med Chem (2012) 55: 9619-9629 [PMID:23067387] |
ChEMBL | Inhibition of human membrane bound carbonic anhydrase 12 preincubated for 15 mins at room temperature followed by 72 hrs at 4 degC by stopped flow CO2 hydration assay | B | 7.89 | pKi | 13 | nM | Ki | Bioorg Med Chem (2013) 21: 5973-5982 [PMID:23965175] |
ChEMBL | Inhibition of human transmembrane carbonic anhydrase 12 by stopped-flow CO2 hydration assay | B | 7.89 | pKi | 13 | nM | Ki | Bioorg Med Chem (2014) 22: 1586-1595 [PMID:24513184] |
GtoPdb | - | - | 7.89 | pKi | 13 | nM | Ki | Bioorg Med Chem (2013) 21: 5973-82 [PMID:23965175] |
carbonic anhydrase 13/Carbonic anhydrase XIII in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3912] [GtoPdb: 2748] [UniProtKB: Q8N1Q1] | ||||||||
ChEMBL | Inhibition of human recombinant CA13 catalytic domain pre-incubated for 15 mins by stopped-flow CO2 hydration method | B | 6.37 | pKi | 425 | nM | Ki | J Med Chem (2012) 55: 9619-9629 [PMID:23067387] |
carbonic anhydrase 13/Carbonic anhydrase XIII in Mouse (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2186] [GtoPdb: 2748] [UniProtKB: Q9D6N1] | ||||||||
ChEMBL | Inhibitory activity against murine carbonic anhydrase XIII (mCA XIII) by using CO2 hydrase assay method | B | 6.37 | pKi | 425 | nM | Ki | Bioorg Med Chem Lett (2004) 14: 3757-3762 [PMID:15203157] |
carbonic anhydrase 14/Carbonic anhydrase XIV in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3510] [GtoPdb: 2598] [UniProtKB: Q9ULX7] | ||||||||
ChEMBL | Inhibition of human recombinant CA14 catalytic domain pre-incubated for 15 mins by stopped-flow CO2 hydration method | B | 6.97 | pKi | 107 | nM | Ki | J Med Chem (2012) 55: 9619-9629 [PMID:23067387] |
COX-1 /Cyclooxygenase-1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL221] [GtoPdb: 1375] [UniProtKB: P23219] | ||||||||
ChEMBL | Inhibition of human cyclooxygenase-1 expressed in COS cells | B | 4 | pIC50 | >100000 | nM | IC50 | Bioorg Med Chem Lett (2004) 14: 5445-5448 [PMID:15454242] |
ChEMBL | Inhibition of human COX1 expressed in african green monkey COS cells assessed as inhibition of arachidonic acid-stimulated PGE2 treated 1 hr before arachidonic acid challenge by enzyme immunoassay | B | 4 | pIC50 | >100000 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 4504-4508 [PMID:19520573] |
ChEMBL | Inhibition of COX1 in LPS-induced human whole blood assessed as PGE2 production | B | 4.46 | pIC50 | 34300 | nM | IC50 | J Med Chem (2008) 51: 4476-4481 [PMID:18598017] |
ChEMBL | In vitro inhibitory concentration against Prostaglandin G/H synthase 1 in human whole blood assay | B | 4.57 | pIC50 | 27000 | nM | IC50 | J Med Chem (2004) 47: 4881-4890 [PMID:15369392] |
COX-2 /Cyclooxygenase-2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL230] [GtoPdb: 1376] [UniProtKB: P35354] | ||||||||
ChEMBL | Inhibition of COX2 in human whole blood assessed as effect on thrombin-induced TXB2 production | B | 6.18 | pIC50 | 660 | nM | IC50 | J Med Chem (2008) 51: 4476-4481 [PMID:18598017] |
ChEMBL | In vitro inhibitory concentration against Prostaglandin G/H synthase 2 in human whole blood assay | B | 6.24 | pIC50 | 570 | nM | IC50 | J Med Chem (2004) 47: 4881-4890 [PMID:15369392] |
ChEMBL | DRUGMATRIX: Cyclooxygenase COX-2 enzyme inhibition (substrate: Arachidonic acid) | B | 6.68 | pIC50 | 208 | nM | IC50 | DrugMatrix in vitro pharmacology data |
ChEMBL | Inhibition of human COX2 expressed in african green monkey COS cells assessed as inhibition of arachidonic acid-stimulated PGE2 production treated 1 hr before arachidonic acid challenge by enzyme immunoassay | B | 6.74 | pIC50 | 183 | nM | IC50 | Bioorg Med Chem Lett (2009) 19: 4504-4508 [PMID:19520573] |
ChEMBL | Inhibition of human cyclooxygenase-2 expressed in COS cells | B | 6.74 | pIC50 | 183 | nM | IC50 | Bioorg Med Chem Lett (2004) 14: 5445-5448 [PMID:15454242] |
ChEMBL | Inhibition of recombinant human COX-2 assessed as reduction of prostaglandin-G2 to prostaglandin-H2 by measuring oxidation of 10-acetyl-3,7-dihydroxyphenoxazine to resorufin after 5 mins by fluorescence based assay | B | 7.3 | pIC50 | 50 | nM | IC50 | Medchemcomm (2018) 9: 534-544 [PMID:30108944] |
ChEMBL | Inhibition of human recombinant COX2 | B | 7.4 | pIC50 | 40 | nM | IC50 | J Med Chem (2008) 51: 142-147 [PMID:18072726] |
ChEMBL | Inhibition of human Prostaglandin G/H synthase 2 | B | 8.3 | pIC50 | 5.01 | nM | IC50 | J Med Chem (2001) 44: 3223-3230 [PMID:11563921] |
GtoPdb | - | - | 8.3 | pIC50 | 5 | nM | IC50 | J Med Chem (2000) 43: 775-7 [PMID:10715145] |
ChEMBL | Inhibitory activity against human recombinant cyclooxygenase 2 | B | 8.3 | pIC50 | 5 | nM | IC50 | Bioorg Med Chem Lett (2005) 15: 4699-4702 [PMID:16153836] |
ChEMBL | In Vitro activity of compound against human recombinant Prostaglandin G/H synthase 2 | B | 8.3 | pIC50 | 5 | nM | IC50 | J Med Chem (2000) 43: 775-777 [PMID:10715145] |
ChEMBL | Compound was tested for its inhibitory activity against recombinant human Prostaglandin G/H synthase 2 | B | 8.3 | pIC50 | 5 | nM | IC50 | J Med Chem (2000) 43: 1661-1663 [PMID:10794682] |
ChEMBL | Inhibition of recombinant human COX-2 by radioligand displacement assay | B | 8.3 | pIC50 | 5 | nM | IC50 | Medchemcomm (2018) 9: 534-544 [PMID:30108944] |
ChEMBL | In Vitro activity of compound against human recombinant Prostaglandin G/H synthase 2 | B | 8.3 | pIC50 | 5 | nM | IC50 | J Med Chem (2000) 43: 775-777 [PMID:10715145] |
ChEMBL | Inhibition of recombinant human COX-2 expressed in Baculovirus infected sf9 cells using arachidonic acid as substrate preincubated for 10 mins followed by substrate addition measured after 10 mins by ELISA | B | 8.3 | pIC50 | 5 | nM | IC50 | Eur J Med Chem (2019) 162: 1-17 [PMID:30396033] |
Cytochrome c oxidase subunit 1 in Sheep (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL6011] [UniProtKB: O78749] | ||||||||
ChEMBL | Inhibition of ovine cyclooxygenase 1 | B | 4.02 | pIC50 | 96200 | nM | IC50 | Bioorg Med Chem (2008) 16: 5322-5330 [PMID:18353655] |
Cytochrome c oxidase subunit 2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL6174] [UniProtKB: P00403] | ||||||||
ChEMBL | Inhibition of human recombinant cyclooxygenase 2 | B | 5.96 | pIC50 | 1100 | nM | IC50 | Bioorg Med Chem (2008) 16: 5322-5330 [PMID:18353655] |
Delta carbonic anhydrase in Thalassiosira weissflogii (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3097982] [UniProtKB: Q5U9J1] | ||||||||
ChEMBL | Inhibition of Thalassiosira weissflogii delta carbonic anhydrase preincubated for 15 mins by stopped flow CO2 hydration assay | B | 6.42 | pKi | 378 | nM | Ki | Bioorg Med Chem Lett (2014) 24: 275-279 [PMID:24314394] |
NET/Norepinephrine transporter in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL222] [GtoPdb: 926] [UniProtKB: P23975] | ||||||||
ChEMBL | DRUGMATRIX: Norepinephrine Transporter radioligand binding (ligand: [125I] RTI-55) | B | 5.54 | pKi | 2903 | nM | Ki | DrugMatrix in vitro pharmacology data |
ChEMBL | DRUGMATRIX: Norepinephrine Transporter radioligand binding (ligand: [125I] RTI-55) | B | 5.53 | pIC50 | 2927 | nM | IC50 | DrugMatrix in vitro pharmacology data |
PROBABLE TRANSMEMBRANE CARBONIC ANHYDRASE (CARBONATE DEHYDRATASE) (CARBONIC DEHYDRATASE) in Mycobacterium tuberculosis (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5767] [UniProtKB: P96878] | ||||||||
ChEMBL | Inhibition of Mycobacterium tuberculosis recombinant carbonic anhydrase Rv3273 pre-incubated for 15 mins by stopped-flow CO2 hydration method | B | 5.11 | pKi | 7810 | nM | Ki | J Med Chem (2012) 55: 9619-9629 [PMID:23067387] |
Uncharacterized protein Rv1284/MT1322 in Mycobacterium tuberculosis (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5631] [UniProtKB: P9WPJ7] | ||||||||
ChEMBL | Inhibition of Mycobacterium tuberculosis recombinant carbonic anhydrase 1 encoded by Rv1284 by stopped flow CO2 hydration assay | B | 4.89 | pKi | 12970 | nM | Ki | J Med Chem (2009) 52: 3116-3120 [PMID:19338333] |
ChEMBL | Inhibition of Mycobacterium tuberculosis recombinant carbonic anhydrase Rv1284 pre-incubated for 15 mins by stopped-flow CO2 hydration method | B | 4.89 | pKi | 12970 | nM | Ki | J Med Chem (2012) 55: 9619-9629 [PMID:23067387] |
ChEMBL data shown on this page come from version 34:
Zdrazil B, Felix E, Hunter F, Manners EJ, Blackshaw J, Corbett S, de Veij M, Ioannidis H, Lopez DM, Mosquera JF, Magarinos MP, Bosc N, Arcila R, Kizilören T, Gaulton A, Bento AP, Adasme MF, Monecke P, Landrum GA, Leach AR. (2024). The ChEMBL Database in 2023: a drug discovery platform spanning multiple bioactivity data types and time periods. Nucleic Acids Res., 52(D1). DOI: 10.1093/nar/gkad1004. [EPMCID:10767899] [PMID:37933841]
Davies M, Nowotka M, Papadatos G, Dedman N, Gaulton A, Atkinson F, Bellis L, Overington JP. (2015) 'ChEMBL web services: streamlining access to drug discovery data and utilities.' Nucleic Acids Res., 43(W1). DOI: 10.1093/nar/gkv352. [EPMCID:25883136]