Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Corticotropin-releasing factor receptor 1' and Ligand = 'BDBM50413237'   

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))	BDBM50413237 (CHEMBL488592) Show SMILES Cc1nc2c(cc(C)nc2n1-c1ccc(cc1C(F)(F)F)C(F)(F)F)-n1ccc(n1)-c1nccs1 |(.44,-25.52,;-1.1,-25.52,;-2.01,-24.26,;-3.48,-24.74,;-4.82,-23.98,;-6.15,-24.75,;-6.15,-26.29,;-7.48,-27.06,;-4.81,-27.06,;-3.48,-26.29,;-2.01,-26.77,;-1.53,-28.23,;-2.56,-29.38,;-2.09,-30.84,;-.58,-31.16,;.45,-30.01,;-.03,-28.55,;1,-27.4,;2.08,-26.3,;-.13,-26.35,;2.11,-28.46,;-.1,-32.62,;.29,-34.11,;1.37,-32.19,;-1.58,-33.07,;-4.82,-22.44,;-6.07,-21.54,;-5.6,-20.07,;-4.06,-20.07,;-3.58,-21.53,;-3.15,-18.82,;-1.61,-18.82,;-1.14,-17.35,;-2.39,-16.47,;-3.63,-17.36,)| Show InChI InChI=1S/C22H14F6N6S/c1-11-9-17(33-7-5-15(32-33)20-29-6-8-35-20)18-19(30-11)34(12(2)31-18)16-4-3-13(21(23,24)25)10-14(16)22(26,27)28/h3-10H,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Medicines Research Centre Curated by ChEMBL					Assay Description Displacement of [125I]sauvagine from human recombinant CRF1 receptor expressed in CHO cells by SPA				J Med Chem 51: 7273-86 (2009) Article DOI: 10.1021/jm800743q BindingDB Entry DOI: 10.7270/Q2TT4S62
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