Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Focal adhesion kinase 1' and Ligand = 'BDBM134150'   

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
Focal adhesion kinase 1 (Homo sapiens (Human))	BDBM134150 (US8846689, 152) Show SMILES CO[C@@H]1CN(C)CC[C@@H]1NC(=O)c1cc(OC)c(Nc2ncc(Cl)c(Oc3cccc4[C@H](C)N(C)C(=O)c34)n2)cc1Cl |r| Show InChI InChI=1S/C29H32Cl2N6O5/c1-15-16-7-6-8-22(25(16)28(39)37(15)3)42-27-19(31)13-32-29(35-27)34-21-12-18(30)17(11-23(21)40-4)26(38)33-20-9-10-36(2)14-24(20)41-5/h6-8,11-13,15,20,24H,9-10,14H2,1-5H3,(H,33,38)(H,32,34,35)/t15-,20-,24+/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1	n/a	n/a	n/a	n/a	7.5	n/a
Boehringer Ingelheim International GmbH US Patent					Assay Description This test uses active PTK2 enzyme (Invitrogen Code PV3832) and poly-Glu-Tyr (4:1, Sigma P-0275) as the kinase substrate. The kinase activity is detec...				US Patent US8846689 (2014) BindingDB Entry DOI: 10.7270/Q2BC3X7Z
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