pristimerin [Ligand Id: 13530] activity data from GtoPdb and ChEMBL

Click here for a description of the charts and data table

Please tell us if you are using this feature and what you think!

ChEMBL ligand: CHEMBL54804 (GNF-Pf-476, Pristimerine)
  • αβ-Hydrolase 6/Monoacylglycerol lipase ABHD6 in Human [ChEMBL: CHEMBL2189127] [GtoPdb: 2919] [UniProtKB: Q9BV23]
There should be some charts here, you may need to enable JavaScript!
  • monoacylglycerol lipase/Monoglyceride lipase in Rat [ChEMBL: CHEMBL3321] [GtoPdb: 1399] [UniProtKB: Q8R431]
There should be some charts here, you may need to enable JavaScript!
  • Nerve Growth factor IB/Nuclear receptor subfamily 4 group A member 1 in Human [ChEMBL: CHEMBL1293229] [GtoPdb: 629] [UniProtKB: P22736]
There should be some charts here, you may need to enable JavaScript!
There should be some charts here, you may need to enable JavaScript!
  • CoV Replicase polyprotein 1ab/CoV RNA-dependent RNA polymerase/CoV Non-structural protein 15/Replicase polyprotein 1ab in Severe acute respiratory syndrome-related coronavirus [ChEMBL: CHEMBL5118] [GtoPdb: 312531393206] [UniProtKB: P0C6X7]
There should be some charts here, you may need to enable JavaScript!
DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
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: 312531393206] [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]