BDBM50389540 CHEMBL2063373

SMILES: COCc1cc(OC)c(c(OC)c1)-c1nc2c(C)ccc(N(CC3CC3)CC3CC3)c2cc1C

InChI Key: InChIKey=NAHAYGAJVWKZIA-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50389540   

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))	BDBM50389540 (CHEMBL2063373) Show SMILES COCc1cc(OC)c(c(OC)c1)-c1nc2c(C)ccc(N(CC3CC3)CC3CC3)c2cc1C |(19.14,-25.33,;20.48,-26.1,;21.81,-25.33,;21.81,-23.79,;20.47,-23.02,;20.47,-21.48,;19.14,-20.71,;17.81,-21.48,;21.81,-20.71,;23.14,-21.48,;24.47,-20.7,;25.81,-21.47,;23.15,-23.01,;21.81,-19.18,;20.47,-18.4,;20.48,-16.86,;19.14,-16.1,;17.81,-16.87,;19.15,-14.55,;20.48,-13.78,;21.81,-14.55,;23.14,-13.77,;24.48,-14.54,;24.48,-16.08,;23.73,-17.41,;25.27,-17.4,;23.14,-12.23,;21.8,-11.47,;21.03,-10.14,;20.26,-11.48,;21.82,-16.1,;23.15,-16.86,;23.15,-18.4,;24.48,-19.17,)| Show InChI InChI=1S/C29H36N2O3/c1-18-6-11-24(31(15-20-7-8-20)16-21-9-10-21)23-12-19(2)29(30-28(18)23)27-25(33-4)13-22(17-32-3)14-26(27)34-5/h6,11-14,20-21H,7-10,15-17H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	88	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Co., Ltd Curated by ChEMBL					Assay Description Displacement of [125I]-CRF from human CRF1 receptor expressed in HEK293 cells after 2 hrs				Bioorg Med Chem Lett 22: 5372-8 (2012) Article DOI: 10.1016/j.bmcl.2012.07.047 BindingDB Entry DOI: 10.7270/Q2736S12
					More data for this Ligand-Target Pair
Corticotropin releasing factor receptor 1 (Homo sapiens (Human))	BDBM50389540 (CHEMBL2063373) Show SMILES COCc1cc(OC)c(c(OC)c1)-c1nc2c(C)ccc(N(CC3CC3)CC3CC3)c2cc1C |(19.14,-25.33,;20.48,-26.1,;21.81,-25.33,;21.81,-23.79,;20.47,-23.02,;20.47,-21.48,;19.14,-20.71,;17.81,-21.48,;21.81,-20.71,;23.14,-21.48,;24.47,-20.7,;25.81,-21.47,;23.15,-23.01,;21.81,-19.18,;20.47,-18.4,;20.48,-16.86,;19.14,-16.1,;17.81,-16.87,;19.15,-14.55,;20.48,-13.78,;21.81,-14.55,;23.14,-13.77,;24.48,-14.54,;24.48,-16.08,;23.73,-17.41,;25.27,-17.4,;23.14,-12.23,;21.8,-11.47,;21.03,-10.14,;20.26,-11.48,;21.82,-16.1,;23.15,-16.86,;23.15,-18.4,;24.48,-19.17,)| Show InChI InChI=1S/C29H36N2O3/c1-18-6-11-24(31(15-20-7-8-20)16-21-9-10-21)23-12-19(2)29(30-28(18)23)27-25(33-4)13-22(17-32-3)14-26(27)34-5/h6,11-14,20-21H,7-10,15-17H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	46	n/a	n/a	n/a	n/a	n/a	n/a
Eisai Co., Ltd Curated by ChEMBL					Assay Description Antagonist activity at human CRF1 receptor expressed in HEK293 cells assessed as inhibition of CRF-stimulated intracellular cAMP accumulation after 3...				Bioorg Med Chem Lett 22: 5372-8 (2012) Article DOI: 10.1016/j.bmcl.2012.07.047 BindingDB Entry DOI: 10.7270/Q2736S12
					More data for this Ligand-Target Pair