Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Insulin receptor' and Ligand = 'BDBM50092148'   

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
Insulin receptor (Homo sapiens (Human))	BDBM50092148 (2-Benzo[b]thiophen-3-yl-3,6-dihydroxy-5-phenyl-[1,...) Show SMILES O=C1C(c2csc3ccccc23)C(=O)C(=O)C(C1=O)c1ccccc1 |(8.69,-8.66,;8.69,-7.12,;7.37,-6.35,;6.03,-7.12,;6.52,-8.59,;5.28,-9.5,;4.04,-8.62,;2.53,-8.97,;1.47,-7.82,;1.94,-6.32,;3.46,-5.98,;4.51,-7.12,;7.37,-4.81,;6.03,-4.04,;8.69,-4.04,;8.69,-2.5,;10.02,-4.81,;10.02,-6.35,;11.36,-7.12,;11.36,-4.04,;11.35,-2.52,;12.68,-1.75,;14.03,-2.53,;14.02,-4.07,;12.68,-4.83,)| Show InChI InChI=1S/C20H12O4S/c21-17-15(11-6-2-1-3-7-11)18(22)20(24)16(19(17)23)13-10-25-14-9-5-4-8-12(13)14/h1-10,15-16H	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Activation of human insulin receptor tyrosine kinase (IRTK)				J Med Chem 43: 3487-94 (2000) BindingDB Entry DOI: 10.7270/Q2NV9HHG
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