Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Proto-oncogene tyrosine-protein kinase Src' and Ligand = 'BDBM50321982'   

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
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50321982 (CHEMBL1173298 | N-(4-Aminosulfonylphenyl)-2-(4-(2-...) Show SMILES NS(=O)(=O)c1ccc(Nc2nc(nc3nc[nH]c23)N2CCN(CCO)CC2)cc1 Show InChI InChI=1S/C17H22N8O3S/c18-29(27,28)13-3-1-12(2-4-13)21-16-14-15(20-11-19-14)22-17(23-16)25-7-5-24(6-8-25)9-10-26/h1-4,11,26H,5-10H2,(H2,18,27,28)(H2,19,20,21,22,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
Chinese Academy of Sciences Curated by ChEMBL					Assay Description Inhibition cSRC				Bioorg Med Chem 18: 4615-24 (2011) Article DOI: 10.1016/j.bmc.2010.05.032 BindingDB Entry DOI: 10.7270/Q26H4JCQ
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