Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Corticotropin-releasing factor receptor 1' and Ligand = 'BDBM50420933'   

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))	BDBM50420933 (CHEMBL2087797) Show SMILES COCc1cc(OC)c(c(OC)c1)-c1cccc2c(N(CC3CCOCC3)CC3(O)CC3)c(SC)nn12 |(3.02,-8.94,;3.01,-7.4,;1.67,-6.64,;1.66,-5.1,;2.99,-4.32,;2.98,-2.78,;4.31,-2,;5.64,-2.76,;1.64,-2.02,;.31,-2.8,;-1.03,-2.04,;-2.36,-2.82,;.32,-4.34,;1.63,-.48,;2.95,.3,;2.94,1.84,;1.6,2.6,;.28,1.82,;-1.19,2.28,;-1.83,4.18,;-3.33,4.49,;-3.74,5.97,;-5.23,6.36,;-5.64,7.85,;-4.56,8.94,;-3.07,8.56,;-2.66,7.07,;-.8,5.33,;.75,5.32,;1.52,6.66,;1,3.81,;2.18,4.79,;-2.09,1.03,;-3.63,1.02,;-4.41,2.34,;-1.17,-.21,;.29,.28,)| Show InChI InChI=1S/C28H37N3O5S/c1-33-17-20-14-23(34-2)25(24(15-20)35-3)21-6-5-7-22-26(27(37-4)29-31(21)22)30(18-28(32)10-11-28)16-19-8-12-36-13-9-19/h5-7,14-15,19,32H,8-13,16-18H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	98	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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