Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase B-raf' and Ligand = 'BDBM50199443'   

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))	BDBM50199443 (CHEMBL3926927) Show SMILES CNC(=O)c1cc(Oc2ccc(cc2)C(=O)\C=C\c2ccccc2)ccn1 Show InChI InChI=1S/C22H18N2O3/c1-23-22(26)20-15-19(13-14-24-20)27-18-10-8-17(9-11-18)21(25)12-7-16-5-3-2-4-6-16/h2-15H,1H3,(H,23,26)/b12-7+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Jiangxi Science& Technology Normal University Curated by ChEMBL					Assay Description Inhibition of BRAF (unknown origin) using FAM-labeled peptide as substrate after 1 hr by Lanthascreen assay				Bioorg Med Chem Lett 26: 5450-5454 (2016) Article DOI: 10.1016/j.bmcl.2016.10.029 BindingDB Entry DOI: 10.7270/Q2JD4ZRP
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