Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'DNA polymerase I, thermostable' and Ligand = 'BDBM50327438'   

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)	BDBM50327438 (3-(1-acetyl-5-(4-hydroxyphenyl)-4,5-dihydro-1H-pyr...) Show SMILES CC(=O)N1N=C(CC1c1ccc(O)cc1)c1cc2ccccc2oc1=O |c:4| Show InChI InChI=1S/C20H16N2O4/c1-12(23)22-18(13-6-8-15(24)9-7-13)11-17(21-22)16-10-14-4-2-3-5-19(14)26-20(16)25/h2-10,18,24H,11H2,1H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.85E+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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