Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Corticotropin-releasing factor receptor 1' and Ligand = 'BDBM50076904'   

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))	BDBM50076904 (3-(2-Bromo-4-isopropyl-phenyl)-7-(di-sec-butyl-ami...) Show SMILES CCC(C)N(C(C)CC)c1nc(C)nc2n(-c3ccc(cc3Br)C(C)C)c(=S)sc12 |(11.24,-9.46,;12.59,-10.23,;12.59,-11.75,;11.26,-12.52,;13.92,-12.52,;15.25,-11.75,;16.6,-12.52,;15.25,-10.21,;16.59,-9.43,;13.93,-14.06,;12.59,-14.83,;12.59,-16.39,;11.26,-17.16,;13.93,-17.16,;15.28,-16.37,;16.75,-16.85,;17.23,-18.3,;16.2,-19.45,;16.68,-20.92,;18.19,-21.22,;19.22,-20.06,;18.71,-18.62,;19.83,-17.52,;18.68,-22.69,;17.66,-23.84,;20.18,-23,;17.65,-15.6,;19.19,-15.6,;16.73,-14.35,;15.27,-14.83,)| Show InChI InChI=1S/C23H31BrN4S2/c1-8-14(5)27(15(6)9-2)21-20-22(26-16(7)25-21)28(23(29)30-20)19-11-10-17(13(3)4)12-18(19)24/h10-15H,8-9H2,1-7H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	45	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Binding affinity against human Corticotropin releasing factor receptor 1 expressed in HEK 293E cells using [125I]-TYR-oCRH				Bioorg Med Chem Lett 9: 1185-8 (1999) BindingDB Entry DOI: 10.7270/Q24M93Q4
					More data for this Ligand-Target Pair