BDBM101694 US8530504, 56

SMILES: COCCN(C1CCC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC

InChI Key: InChIKey=MZUNNCKBONSYRQ-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 = 101694   

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))	BDBM101694 (US8530504, 56) Show SMILES COCCN(C1CCC1)c1c(OC)nn2c(csc12)-c1c(OC)cc(COC)cc1OC |(-5.78,7.05,;-5.38,5.56,;-3.9,5.16,;-3.5,3.68,;-2.01,3.28,;-.92,4.37,;.57,4.77,;.17,6.25,;-1.32,5.85,;-1.61,1.79,;-2.52,.54,;-4.06,.54,;-4.83,-.79,;-1.61,-.7,;-.15,-.23,;1.32,-.7,;2.22,.54,;1.32,1.79,;-.15,1.31,;1.72,-2.19,;3.2,-2.59,;4.29,-1.5,;5.78,-1.9,;3.6,-4.08,;2.51,-5.16,;2.91,-6.65,;4.4,-7.05,;5.49,-5.96,;1.03,-4.77,;.63,-3.28,;-.86,-2.88,;-1.95,-3.97,)| Show InChI InChI=1S/C23H31N3O5S/c1-27-10-9-25(16-7-6-8-16)21-22(31-5)24-26-17(14-32-23(21)26)20-18(29-3)11-15(13-28-2)12-19(20)30-4/h11-12,14,16H,6-10,13H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
Eisai R&D Management Co., Ltd. US Patent					Assay Description A binding competition experiment with CRF was conducted by the SPA (GE Healthcare) method using a 96-well plate.				US Patent US8530504 (2013) BindingDB Entry DOI: 10.7270/Q29885NS
					More data for this Ligand-Target Pair