Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Receptor tyrosine-protein kinase erbB-2' and Ligand = 'BDBM50365911'   

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
Receptor tyrosine-protein kinase erbB-2 (Homo sapiens (Human))	BDBM50365911 (CHEMBL1958222) Show SMILES COc1ccc(cc1)C1=NN(C(C1)c1ccc(C)cc1)c1nc(O)cs1 |t:9| Show InChI InChI=1S/C20H19N3O2S/c1-13-3-5-15(6-4-13)18-11-17(14-7-9-16(25-2)10-8-14)22-23(18)20-21-19(24)12-26-20/h3-10,12,18,24H,11H2,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.35E+3	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing University Curated by ChEMBL					Assay Description Inhibition of histidine-tagged human recombinant cytoplasmic domain of HER2 expressed in baculovirus infected insect Sf9 cells after 1 hr by DELFIA/t...				Bioorg Med Chem 20: 2010-8 (2012) Article DOI: 10.1016/j.bmc.2012.01.051 BindingDB Entry DOI: 10.7270/Q27081WW
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