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ChEMBL ligand: CHEMBL54804 (GNF-Pf-476, Pristimerine) |
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DB | Assay description | Assay Type | Standard value | Standard parameter | Original value | Original units | Original parameter | Reference |
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αβ-Hydrolase 6/Monoacylglycerol lipase ABHD6 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL2189127] [GtoPdb: 2919] [UniProtKB: Q9BV23] | ||||||||
ChEMBL | Inhibition of ABHD6 (unknown origin) | B | 5.89 | pIC50 | 1300 | nM | IC50 | Eur J Med Chem (2020) 198: 112353-112353 [PMID:32371333] |
monoacylglycerol lipase/Monoglyceride lipase in Rat (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL3321] [GtoPdb: 1399] [UniProtKB: Q8R431] | ||||||||
GtoPdb | - | - | 7.03 | pIC50 | 93 | nM | IC50 | Bioorg Med Chem Lett (2021) 41: 127986 [PMID:33766770] |
ChEMBL | Inhibition of recombinant rat MAGL by LC-MS analysis | B | 7.03 | pIC50 | 93 | nM | IC50 | Bioorg Med Chem Lett (2021) 41: 127986-127986 [PMID:33766770] |
Nerve Growth factor IB/Nuclear receptor subfamily 4 group A member 1 in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1293229] [GtoPdb: 629] [UniProtKB: P22736] | ||||||||
ChEMBL | Binding affinity to recombinant human N-terminal His-tagged Nur77 LBD (367 to 598 residues) expressed in Escherichia coli BL21(DE3) incubated for 30 secs by fluorescence quenching assay | B | 6.02 | pKd | 960 | nM | Kd | Eur J Med Chem (2019) 177: 171-187 [PMID:31132532] |
GtoPdb | - | - | 6.02 | pKd | 960 | nM | Kd | Eur J Med Chem (2019) 177: 171-187 [PMID:31132532] |
Plasmodium falciparum (target type: ORGANISM) [ChEMBL: CHEMBL364] | ||||||||
ChEMBL | NOVARTIS: Inhibition of Plasmodium falciparum 3D7 (drug-susceptible) proliferation in erythrocyte-based infection assay | F | 5.9 | pEC50 | >1250 | nM | EC50 | Proc Natl Acad Sci U S A (2008) 105: 9059-9064 [PMID:18579783] |
ChEMBL | NOVARTIS: Inhibition of Plasmodium falciparum W2 (drug-resistant) proliferation in erythrocyte-based infection assay | F | 6.09 | pEC50 | >820 | nM | EC50 | Proc Natl Acad Sci U S A (2008) 105: 9059-9064 [PMID:18579783] |
CoV Replicase polyprotein 1ab/CoV RNA-dependent RNA polymerase/CoV Non-structural protein 15/Replicase polyprotein 1ab in Severe acute respiratory syndrome-related coronavirus (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL5118] [GtoPdb: 3125, 3139, 3206] [UniProtKB: P0C6X7] | ||||||||
ChEMBL | Inhibition of 3C-like protease of SARS coronavirus assessed as concentration of FRET peptide for 60 mins by dixon plot | B | 5.51 | pKi | 3100 | nM | Ki | Bioorg Med Chem Lett (2010) 20: 1873-1876 [PMID:20167482] |
ChEMBL | Inhibition of 3C-like protease of SARS coronavirus assessed as concentration of FRET peptide for 60 mins | B | 5.26 | pIC50 | 5500 | nM | IC50 | Bioorg Med Chem Lett (2010) 20: 1873-1876 [PMID:20167482] |
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]