Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Receptor tyrosine-protein kinase erbB-2' and Ligand = 'BDBM50293253'   

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))	BDBM50293253 ((R)-1-(2-((4-(3-chloro-4-(3-fluorobenzyloxy)phenyl...) Show SMILES CC(=O)N1CCC[C@@H]1C#Cc1cc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2s1 |r| Show InChI InChI=1S/C27H22ClFN4O2S/c1-17(34)33-11-3-6-21(33)8-9-22-14-24-26(36-22)27(31-16-30-24)32-20-7-10-25(23(28)13-20)35-15-18-4-2-5-19(29)12-18/h2,4-5,7,10,12-14,16,21H,3,6,11,15H2,1H3,(H,30,31,32)/t21-/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	38	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Research& Development Curated by ChEMBL					Assay Description Inhibition of ErbB2 kinase				Bioorg Med Chem Lett 18: 5738-40 (2009) Article DOI: 10.1016/j.bmcl.2008.09.090 BindingDB Entry DOI: 10.7270/Q2H70FTT
					More data for this Ligand-Target Pair