BDBM50387602 CHEMBL2058597

SMILES: CCC(C1CC1)n1c2nccc(-c3cc(C#N)c(C)cc3Cl)c2nc(C)c1=O

InChI Key: InChIKey=CIIZYTXDTFGMMP-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 = 50387602   

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 (Rattus norvegicus (rat))	BDBM50387602 (CHEMBL2058597) Show SMILES CCC(C1CC1)n1c2nccc(-c3cc(C#N)c(C)cc3Cl)c2nc(C)c1=O Show InChI InChI=1S/C22H21ClN4O/c1-4-19(14-5-6-14)27-21-20(26-13(3)22(27)28)16(7-8-25-21)17-10-15(11-24)12(2)9-18(17)23/h7-10,14,19H,4-6H2,1-3H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.80	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Co Curated by ChEMBL					Assay Description Antagonist activity at rat CFR1R				Bioorg Med Chem Lett 22: 4986-9 (2012) Article DOI: 10.1016/j.bmcl.2012.06.034 BindingDB Entry DOI: 10.7270/Q23X87Q6
					More data for this Ligand-Target Pair