Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase B-raf [V600E]' and Ligand = 'BDBM117452'   

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 [V600E] (Homo sapiens (Human))	BDBM117452 (US8653087, III-132) Show SMILES COCCNc1ncc2ncnc(Nc3cc(ccc3C)C(=O)Nc3ccc(N(C)CCN(C)C)c(c3)C(F)(F)F)c2n1 Show InChI InChI=1S/C29H34F3N9O2/c1-18-6-7-19(14-22(18)38-26-25-23(35-17-36-26)16-34-28(39-25)33-10-13-43-5)27(42)37-20-8-9-24(21(15-20)29(30,31)32)41(4)12-11-40(2)3/h6-9,14-17H,10-13H2,1-5H3,(H,37,42)(H,33,34,39)(H,35,36,38)	PDB UniProtKB/SwissProt 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 The final concentration of DMSO is 5%. 10 μL of the B-Raf (V600E)-kinase solution are pipetted in (containing 0.5 ng B-Raf (V600E)-kinase in 20 ...				US Patent US8653087 (2014) BindingDB Entry DOI: 10.7270/Q2CR5S1G
					More data for this Ligand-Target Pair