BDBM50413236 CHEMBL458780

SMILES: Cc1cc(-n2ccc(n2)-c2nccs2)c2[nH]c(=O)n(-c3ccc(cc3C(F)(F)F)C(F)(F)F)c2n1

InChI Key: InChIKey=KCFNBFVUHNJASQ-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 = 50413236   

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
Corticotropin releasing factor receptor 1 (Homo sapiens (Human))	BDBM50413236 (CHEMBL458780) Show SMILES Cc1cc(-n2ccc(n2)-c2nccs2)c2[nH]c(=O)n(-c3ccc(cc3C(F)(F)F)C(F)(F)F)c2n1 |(21.34,-6.37,;22.68,-5.6,;22.68,-4.05,;24.01,-3.28,;24,-1.74,;22.75,-.84,;23.23,.63,;24.77,.63,;25.25,-.83,;25.68,1.87,;27.22,1.88,;27.69,3.34,;26.44,4.23,;25.19,3.34,;25.34,-4.05,;26.82,-3.57,;27.73,-4.82,;29.27,-4.82,;26.82,-6.08,;27.29,-7.53,;26.26,-8.68,;26.73,-10.14,;28.24,-10.46,;29.27,-9.31,;28.79,-7.85,;29.82,-6.7,;30.91,-5.6,;28.7,-5.65,;30.94,-7.76,;28.72,-11.93,;29.11,-13.41,;30.2,-11.49,;27.25,-12.37,;25.34,-5.6,;24.01,-6.37,)| Show InChI InChI=1S/C21H12F6N6OS/c1-10-8-15(32-6-4-13(31-32)18-28-5-7-35-18)16-17(29-10)33(19(34)30-16)14-3-2-11(20(22,23)24)9-12(14)21(25,26)27/h2-9H,1H3,(H,30,34)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.32E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Medicines Research Centre Curated by ChEMBL					Assay Description Displacement of [125I]sauvagine from human recombinant CRF1 receptor expressed in CHO cells by SPA				J Med Chem 51: 7273-86 (2009) Article DOI: 10.1021/jm800743q BindingDB Entry DOI: 10.7270/Q2TT4S62
					More data for this Ligand-Target Pair