TAM16 [Ligand Id: 9645] activity data from GtoPdb and ChEMBL

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ChEMBL ligand: CHEMBL4443524
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  • polyketide synthase Pks13/Polyketide synthase Pks13 in Mycobacterium tuberculosis [ChEMBL: CHEMBL4105939] [GtoPdb: 2950] [UniProtKB: I6X8D2]
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DB Assay description Assay Type Standard value Standard parameter Original value Original units Original parameter Reference
Kv11.1/HERG in Human (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL240] [GtoPdb: 572] [UniProtKB: Q12809]
ChEMBL Inhibition of hERG ion channel by Q patch-clamp method B 5.16 pIC50 6900 nM IC50 J Med Chem (2022) 65: 409-423 [PMID:34910486]
polyketide synthase Pks13/Polyketide synthase Pks13 in Mycobacterium tuberculosis (target type: SINGLE PROTEIN) [ChEMBL: CHEMBL4105939] [GtoPdb: 2950] [UniProtKB: I6X8D2]
ChEMBL Inhibition of Mycobacterium tuberculosis Pks13-TE domain using 4-methylumbelliferyl heptanoate as a fluorogenic substrate measured for 110 mins at 10 mins interval B 6.49 pIC50 320 nM IC50 J Med Chem (2022) 65: 409-423 [PMID:34910486]
ChEMBL Inhibition of Mycobacterium tuberculosis N-terminal His-6 tagged Pks13 thioesterase domain expressed in Escherichia coli BL21 (DE3) using 4-methylumbelliferyl heptanoate as substrate incubated for 80 to 120 mins by fluorescence based microplate reader assay B 6.7 pIC50 200 nM IC50 J Med Chem (2023) 66: 15380-15408 [PMID:37948640]
GtoPdb - - 6.72 pIC50 190 nM IC50 Cell (2017) 170: 249-259.e25 [PMID:28669536]
ChEMBL Inhibition of Mycobacterium tuberculosis H37Rv Pks13 expressed in Escherichia coli BL21 (DE3)pLysS cells measured for 80 to 120 mins by 4-MUH assay B 6.72 pIC50 190 nM IC50 J Med Chem (2022) 65: 7489-7531 [PMID:35612311]

ChEMBL data shown on this page come from version 35:

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]