Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Focal adhesion kinase 1' and Ligand = 'BDBM134182'   

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))	BDBM134182 (US8846689, 184) Show SMILES CN1Cc2cccc(Oc3nc(Nc4ccc(cc4C)C(=O)NC4CCN(CCO)CC4)ncc3C(F)(F)F)c2C1=O Show InChI InChI=1S/C29H31F3N6O4/c1-17-14-18(25(40)34-20-8-10-38(11-9-20)12-13-39)6-7-22(17)35-28-33-15-21(29(30,31)32)26(36-28)42-23-5-3-4-19-16-37(2)27(41)24(19)23/h3-7,14-15,20,39H,8-13,16H2,1-2H3,(H,34,40)(H,33,35,36)	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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