Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Corticotropin-releasing factor receptor 1' and Ligand = 'BDBM50420924'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/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))	BDBM50420924 (CHEMBL2087571) Show SMILES CCCN(CC1CCOCC1)c1c(CC)nn2c(cccc12)-c1c(OC)cc(C)cc1OC |(-3.23,6.87,;-4.32,5.78,;-3.92,4.3,;-2.41,3.98,;-1.07,5.46,;.45,5.22,;1,3.79,;2.52,3.54,;3.49,4.74,;2.94,6.18,;1.42,6.42,;-1.79,2.07,;-2.7,.83,;-4.24,.83,;-5.01,2.16,;-1.79,-.42,;-.33,.06,;1.01,-.71,;2.34,.06,;2.34,1.6,;1.01,2.37,;-.33,1.6,;1.01,-2.25,;2.34,-3.02,;3.67,-2.25,;5.01,-3.02,;2.34,-4.56,;1.01,-5.33,;1.01,-6.87,;-.33,-4.56,;-.33,-3.02,;-1.66,-2.25,;-2.99,-3.02,)| Show InChI InChI=1S/C27H37N3O3/c1-6-13-29(18-20-11-14-33-15-12-20)27-21(7-2)28-30-22(9-8-10-23(27)30)26-24(31-4)16-19(3)17-25(26)32-5/h8-10,16-17,20H,6-7,11-15,18H2,1-5H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	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 by liquid scintillation counter				J Med Chem 55: 5255-69 (2012) Article DOI: 10.1021/jm300259r BindingDB Entry DOI: 10.7270/Q29P32XC
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