Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Proto-oncogene tyrosine-protein kinase Src' and Ligand = 'BDBM163699'   

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))	BDBM163699 (N-(4-((4-ethylpiperazin-1-yl)methyl)-3-(trifluorom...) Show SMILES CCN1CCN(Cc2ccc(NC(=O)Cc3ccc(cc3)-c3ccc4ccncc4c3)cc2C(F)(F)F)CC1 Show InChI InChI=1S/C31H31F3N4O/c1-2-37-13-15-38(16-14-37)21-26-9-10-28(19-29(26)31(32,33)34)36-30(39)17-22-3-5-23(6-4-22)25-8-7-24-11-12-35-20-27(24)18-25/h3-12,18-20H,2,13-17,21H2,1H3,(H,36,39)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Dana-Farber Cancer Institute					Assay Description The enzymatic activities DDR2 were tested in LanthaScreen binding assays. The protocol is available from Life Technologies.				ACS Chem Biol 10: 2687-96 (2015) Article DOI: 10.1021/acschembio.5b00655 BindingDB Entry DOI: 10.7270/Q2SX6BZ1
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