Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase B-raf' and Ligand = 'BDBM50303128'   

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
Serine/threonine-protein kinase B-raf (Homo sapiens (Human))	BDBM50303128 (7-(8-ethyl-8-azabicyclo[3.2.1]octan-3-yl)-3-(7-met...) Show SMILES CCN1C2CCC1CC(C2)c1ccnc2c(c(nn12)-c1ccncc1)-c1ccc(C)c2[nH]ncc12 |THB:10:8:2:4.5,(10.62,1.13,;9.3,.33,;9.33,-1.21,;8.8,-2.67,;7.28,-3.35,;8.65,-3.32,;9.84,-2.45,;11.38,-3.3,;10.84,-4.77,;10.39,-3.58,;10.84,-6.31,;9.51,-7.08,;9.51,-8.63,;10.84,-9.4,;12.18,-8.63,;13.65,-9.1,;14.56,-7.85,;13.65,-6.6,;12.17,-7.07,;16.09,-7.85,;16.86,-9.18,;18.4,-9.18,;19.17,-7.85,;18.39,-6.51,;16.86,-6.52,;13.72,-10.64,;12.42,-11.46,;12.48,-13,;13.84,-13.72,;13.9,-15.26,;15.15,-12.9,;16.64,-13.31,;17.5,-12.01,;16.53,-10.8,;15.08,-11.35,)| Show InChI InChI=1S/C28H29N7/c1-3-34-20-5-6-21(34)15-19(14-20)24-10-13-30-28-25(22-7-4-17(2)26-23(22)16-31-32-26)27(33-35(24)28)18-8-11-29-12-9-18/h4,7-13,16,19-21H,3,5-6,14-15H2,1-2H3,(H,31,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of B-Raf				Bioorg Med Chem Lett 19: 6957-61 (2009) Article DOI: 10.1016/j.bmcl.2009.10.058 BindingDB Entry DOI: 10.7270/Q2833S34
					More data for this Ligand-Target Pair