BDBM50314054 CHEMBL1093104::N-(3-(2-(4-methylpiperazin-1-yl)pyrazolo[1,5-a]pyrimidin-7-yl)phenyl)-3-(trifluoromethyl)benzamide

SMILES: CN1CCN(CC1)c1cc2nccc(-c3cccc(NC(=O)c4cccc(c4)C(F)(F)F)c3)n2n1

InChI Key: InChIKey=IVFOMDILWVRNQN-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50314054   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/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))	BDBM50314054 (CHEMBL1093104 | N-(3-(2-(4-methylpiperazin-1-yl)py...) Show SMILES CN1CCN(CC1)c1cc2nccc(-c3cccc(NC(=O)c4cccc(c4)C(F)(F)F)c3)n2n1 Show InChI InChI=1S/C25H23F3N6O/c1-32-10-12-33(13-11-32)23-16-22-29-9-8-21(34(22)31-23)17-4-3-7-20(15-17)30-24(35)18-5-2-6-19(14-18)25(26,27)28/h2-9,14-16H,10-13H2,1H3,(H,30,35)	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	>1.00E+4	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: 6890-2 (2009) Article DOI: 10.1016/j.bmcl.2009.10.074 BindingDB Entry DOI: 10.7270/Q2C829F3
					More data for this Ligand-Target Pair