compound 9h [PMID: 32697083] [Ligand Id: 13040] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL4633662
  • BLM RecQ like helicase/Bloom syndrome protein in Human [ChEMBL: CHEMBL1293237] [GtoPdb: 3260] [UniProtKB: P54132]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
BLM RecQ like helicase/Bloom syndrome protein in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL1293237] [GtoPdb: 3260] [UniProtKB: P54132]
ChEMBL Binding affinity to His-tagged BLM I1168A mutant (unknown origin) expressed in Escherichia coli BL21 (DE3) cells by isothermal calorimetric titration assay B 5.18 pKd 6540 nM Kd J Med Chem (2020) 63: 9752-9772 [PMID:32697083]
ChEMBL Binding affinity to His-tagged BLM H996A mutant (unknown origin) expressed in Escherichia coli BL21 (DE3) cells by isothermal calorimetric titration assay B 5.85 pKd 1400 nM Kd J Med Chem (2020) 63: 9752-9772 [PMID:32697083]
ChEMBL Binding affinity to wild-type His-tagged BLM (642 to 1296 residues) (unknown origin) expressed in Escherichia coli BL21 (DE3) cells by isothermal calorimetric titration assay B 6.12 pKd 760 nM Kd J Med Chem (2020) 63: 9752-9772 [PMID:32697083]
GtoPdb Binding affinity for wild-type BLM (642-1296) expressed in Escherichia coli, setermined by isothermal calorimetric titration (ICT) assay. - 6.12 pKd 760 nM Kd J Med Chem (2020) 63: 9752-9772 [PMID:32697083]
ChEMBL Inhibition of BLM (unknown origin) assessed as ATP hydrolysis using 5'-biotin-labeled duplex forked-DNA as substrate incubated for 10 mins in presence of ATP by luciferase assay B 4.49 pIC50 >32000 nM IC50 Eur J Med Chem (2023) 246: 114944-114944 [PMID:36459756]
ChEMBL Displacement of thiazole orange from His-tagged BLM (unknown origin) expressed in Escherichia coli BL21 (DE3) assessed as decrease in fluorescence intensity by fluorescence based analysis B 5 pIC50 >10000 nM IC50 Eur J Med Chem (2023) 246: 114944-114944 [PMID:36459756]
ChEMBL Binding affinity to His-tagged BLM (642 to 1296 residues) (unknown origin) expressed in Escherichia coli BL21 (DE3) cells assessed as inhibition of protein interaction with 5'-biotin-labeled forked DNA measured after 1 hr by ELISA B 5.06 pIC50 8700 nM IC50 J Med Chem (2020) 63: 9752-9772 [PMID:32697083]
ChEMBL Inhibition of His-tagged BLM (unknown origin) expressed in Escherichia coli BL21 (DE3) using 5'-biotin-labeled duplex forked-DNA as substrate incubated for 10 mins followed by substrate addition measured after 30 mins in presence of ATP by electrophoretic mobility shift assay B 5.29 pIC50 5100 nM IC50 Eur J Med Chem (2023) 246: 114944-114944 [PMID:36459756]
ChEMBL Inhibition of His-tagged BLM (642 to 1296 residues) (unknown origin) expressed in Escherichia coli BL21 (DE3) cells assessed as reduction in DNA unwinding activity using 5'-biotin-labeled forked DNA as substrate preincubated for 1 hr followed by substrate addition and measured after 1 hr by electrophoretic mobility shift assay B 6.1 pIC50 800 nM IC50 J Med Chem (2020) 63: 9752-9772 [PMID:32697083]

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]