hydrochlorothiazide [Ligand Id: 4836] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL435 (Esidrex, Hydrosaluric, Microzide, Hydrochlorothiazide component of monopril hct, Servithiazid, Hydrochlorothiazide component of lotensin hct, Hydrochlorothiazide component of hydroserpine plus (r-h-h), Hydrochlorothiazide component of maxzide, Hydrochlorothiaizide, Chlorosulthiadil, Hydrochlorothiazide component of esimil, Zide, Pantemon, Hydrochlorothiazide component of irbesartan/ teva, Hydrochlorothiazide component of teveten hct, Esidrix, Hydrochlorothiazide component of lopressor hct, Hydrochlorothiazide component of avalide, Hydrochlorothiazide component of hyzaar, Hydrochlorothiazide component of dutoprol, Hydrochlorothiazide component of viskazide, Hydrochlorothiazide component of micardis hct, Hydrochlorothiazide component of cam-ap-es, Hydrodiuril, Hydrochlorothiazide component of tekturna hct, Hydrochlorothiazide component of ser-ap-es, SU-5879, Hydrochlorothiazide component of oreticyl forte, Hydrochlorothiazide component of moduretic, Hydrochlorothiazide component of ziac, Exforge-hct, Hydrochlorothiazide component of h.r.-50, Hydrochlorothiazide component of hydra-zide, Hydrochlorothiazide component of irbesartan/-bms, Hydrochlorothiazide component of exforge hct, Hydrochlorothiazide component of apresoline-esidrix, Hydrochlorothiazide component of kinzalkomb, Hydrochlorothiazide component of serpasil-esidrix, NSC-53477, Rasilez-hct, Oretic, Hydrochlorothiazide component of ibersartan/ zentiva, Hidroclorotiazida, Hydrochlorothiazide, Dafiro-hct, Hydrochlorothiazide component of benicar hct, Hydrochlorothiazide component of tolucombi, Hydrochlorothiazide component of aldoril, Hydrochlorothiazide component of unipres, Hydrochlorothiazide component of ifirmacombi, Copalia-hct, Hidrotiazida, Hydrochlorothiazide component of vaseretic, Hydrochlorothiazide component of quinaretic, Hydrochlorothiazide component of pritorplus, Unipres, Hydrochlorothiazide component of riprazo, Megadiuril, Hydrochlorothiazide component of hydralazine hydrochloride--reserpine, Hydrochlorothiazide component of sprimeo-hct, Hydrochlorothiazide component of rasitrio, Apo-hydro, Ziac, Carozide, Hydrochlorothiazide intensol, Hydrochlorothiazide component of amturnide, Hydrochlorothiazide component of tribenzor, Hydrochlorothiazide component of uniretic, Hydrochlorothiazide component of prinzide, Hydrochlorothiazide component of hydro-ride, Lotensin hct, Newtolide, Hydrochlorothiazide component of normozide, Hydrochlorothiazide component of kervezide, Hydrochlorothiazide component of diovan hct, Hydrochlorothiazide component of hydro-reserp, Hydrochlorothiazide component of micardisplus, Hydrochlorothiazide component of polycap, Hydro-d, Hydrochlorothiazide component of zestoretic, Dihydrochlorurite, Hydrochlorothiazide component of hydropres, Hydrochlorothiazide component of accuretic, Vetidrex, Imprida-hct, Hydrochlorothiazide component of dyazide, Hydrochlorothiazide component of apresazide, Hydrochlorothiazide component of hydrap-es, Hydrochlorthiazide, Idrotiazide, Hydrochlorothiazide component of ser-a-gen, Hydrochlorothiazide component of aldactazide, Hydrochlorothiazidum, Apresazide)
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  • Carbonate dehydratase in Sulfurihydrogenibium sp. (strain YO3AOP1) [ChEMBL: CHEMBL3745586] [UniProtKB: B2V8E3]
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  • carbonic anhydrase 1/Carbonic anhydrase 1 in Human [ChEMBL: CHEMBL261] [GtoPdb: 2597] [UniProtKB: P00915]
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  • carbonic anhydrase 2/Carbonic anhydrase 2 in Human [ChEMBL: CHEMBL205] [GtoPdb: 3092] [UniProtKB: P00918]
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  • Carbonic anhydrase, alpha family in Thiomicrospira crunogena (strain XCL-2) [ChEMBL: CHEMBL3621035] [UniProtKB: Q31FD6]
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  • Delta carbonic anhydrase in Thalassiosira weissflogii [ChEMBL: CHEMBL3097982] [UniProtKB: Q5U9J1]
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  • N-Acylphosphatidylethanolamine-phospholipase D in Human [GtoPdb: 1398] [UniProtKB: Q6IQ20]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
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 7.5 pKi 31.5 nM Ki Bioorg Med Chem (2015) 23: 2303-2309 [PMID:25882523]
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 6.4 pKi 394 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 8.14 pKi 7.2 nM Ki Bioorg Med Chem Lett (2016) 26: 401-405 [PMID:26691758]
carbonic anhydrase 1/Carbonic anhydrase 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL261] [GtoPdb: 2597] [UniProtKB: P00915]
ChEMBL Inhibition of human carbonic anhydrase 1 after 15 mins by CO2 hydrase assay at pH 7.5 B 6.48 pKi 328 nM Ki Bioorg Med Chem (2011) 19: 1847-1851 [PMID:21377369]
ChEMBL Inhibition of human recombinant carbonic anhydrase 1 at pH 7.5 by stopped flow CO2 hydration assay B 6.48 pKi 328 nM Ki Bioorg Med Chem (2011) 19: 5023-5030 [PMID:21757360]
ChEMBL Inhibition of human recombinant carbonic anhydrase 1 after 15 mins by stopped flow CO2 hydration assay B 6.48 pKi 328 nM Ki Bioorg Med Chem (2012) 20: 1403-1410 [PMID:22285172]
ChEMBL Inhibition of human recombinant carbonic anhydrase 1 preincubated for 15 mins by stopped-flow CO2 hydrase assay B 6.48 pKi 328 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 6.48 pKi 328 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 6.48 pKi 328 nM Ki Bioorg Med Chem (2013) 21: 1534-1538 [PMID:22883029]
ChEMBL Inhibition of human carbonic anhydrase-1 by stopped-flow CO2 hydration assay B 6.48 pKi 328 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 6.48 pKi 328 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 6.48 pKi 328 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 6.48 pKi 328 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 6.48 pKi 328 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 6.48 pKi 328 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 6.48 pKi 328 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 6.48 pKi 328 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 6.48 pKi 328 nM Ki Bioorg Med Chem Lett (2016) 26: 1821-1826 [PMID:26920803]
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 6.48 pKi 328 nM Ki Bioorg Med Chem Lett (2017) 27: 490-495 [PMID:28025002]
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 6.48 pKi 328 nM Ki Bioorg Med Chem (2017) 25: 3555-3561 [PMID:28511911]
ChEMBL Inhibition of full length human cytosolic carbonic anhydrase 1 preincubated for 15 mins by stop flow CO2 hydrase assay B 6.48 pKi 328 nM Ki Bioorg Med Chem Lett (2016) 26: 4184-4190 [PMID:27485387]
carbonic anhydrase 2/Carbonic anhydrase 2 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL205] [GtoPdb: 3092] [UniProtKB: P00918]
ChEMBL Displacement of dansylamide from human recombinant CA II expressed in Escherichia coli BL21 DE3 assessed as dissociation constant by fluorescence microplate reader B 5.14 pKd 7190 nM Kd J Med Chem (2024) 67: 15862-15872 [PMID:39161321]
ChEMBL Binding affinity to human recombinant CA II assessed as dissociation constant B 5.59 pKd 2600 nM Kd J Med Chem (2024) 67: 15862-15872 [PMID:39161321]
ChEMBL Inhibition of human carbonic anhydrase 2 after 15 mins by CO2 hydrase assay at pH 7.5 B 6.54 pKi 290 nM Ki Bioorg Med Chem (2011) 19: 1847-1851 [PMID:21377369]
ChEMBL Inhibition of human recombinant carbonic anhydrase 2 at pH 7.5 by stopped flow CO2 hydration assay B 6.54 pKi 290 nM Ki Bioorg Med Chem (2011) 19: 5023-5030 [PMID:21757360]
ChEMBL Inhibition of human recombinant carbonic anhydrase 2 after 15 mins by stopped flow CO2 hydration assay B 6.54 pKi 290 nM Ki Bioorg Med Chem (2012) 20: 1403-1410 [PMID:22285172]
ChEMBL Inhibition of human recombinant carbonic anhydrase 2 preincubated for 15 mins by stopped-flow CO2 hydrase assay B 6.54 pKi 290 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 6.54 pKi 290 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 6.54 pKi 290 nM Ki Bioorg Med Chem (2013) 21: 1534-1538 [PMID:22883029]
ChEMBL Inhibition of human recombinant carbonic anhydrase 2 preincubated for 15 mins by stopped flow CO2 hydration assay B 6.54 pKi 290 nM Ki Bioorg Med Chem Lett (2014) 24: 275-279 [PMID:24314394]
ChEMBL Inhibition of human carbonic anhydrase-2 by stopped-flow CO2 hydration assay B 6.54 pKi 290 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 6.54 pKi 290 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 6.54 pKi 290 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 6.54 pKi 290 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 6.54 pKi 290 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 6.54 pKi 290 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 6.54 pKi 290 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 6.54 pKi 290 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 6.54 pKi 290 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 6.54 pKi 290 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 6.54 pKi 290 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 6.54 pKi 290 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 6.54 pKi 290 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 6.54 pKi 290 nM Ki Bioorg Med Chem Lett (2016) 26: 4184-4190 [PMID:27485387]
ChEMBL Binding affinity to human recombinant CA II assessed as inhibition constant B 6.54 pKi 290 nM Ki J Med Chem (2024) 67: 15862-15872 [PMID:39161321]
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 6.53 pKi 296 nM Ki Bioorg Med Chem Lett (2016) 26: 401-405 [PMID:26691758]
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 5.37 pKi 4270 nM Ki Bioorg Med Chem Lett (2014) 24: 275-279 [PMID:24314394]
N-Acylphosphatidylethanolamine-phospholipase D in Human [GtoPdb: 1398] [UniProtKB: Q6IQ20]
GtoPdb Determined by surface plasmon resonance, in the absence of deoxycholic acid in the bile acid binding domain - 5.1 pKd 8000 nM Kd Cell Chem Biol (2025) 32: 449-462.e5 [PMID:39999832]
GtoPdb equilibrium dissociation constant in presence of deoxycholic acid, determined by SPR - 6.13 pKd 740 nM Kd Cell Chem Biol (2025) 32: 449-462.e5 [PMID:39999832]

ChEMBL data shown on this page come from version 36:

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]