Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'DNA polymerase I, thermostable' and Ligand = 'BDBM50327443'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
DNA polymerase I, thermostable (Thermus aquaticus)	BDBM50327443 (3-(1-acetyl-5-(4-hydroxyphenyl)-4,5-dihydro-1H-pyr...) Show SMILES CC(=O)N1N=C(CC1c1ccc(O)cc1)c1cc2c(Br)cccc2oc1=O |c:4| Show InChI InChI=1S/C20H15BrN2O4/c1-11(24)23-18(12-5-7-13(25)8-6-12)10-17(22-23)15-9-14-16(21)3-2-4-19(14)27-20(15)26/h2-9,18,25H,10H2,1H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Anhui University of Technology Curated by ChEMBL					Assay Description Inhibition of Taq polymerase				Bioorg Med Chem Lett 20: 5705-8 (2010) Article DOI: 10.1016/j.bmcl.2010.08.017 BindingDB Entry DOI: 10.7270/Q2P84C30
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