Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '11-beta-hydroxysteroid dehydrogenase 1' and Ligand = 'BDBM250448'   

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
11-beta-hydroxysteroid dehydrogenase 1 (Homo sapiens (Human))	BDBM250448 (US9464044, 44) Show SMILES NC(=O)C12CC3CC(C1)[C@H](NC(=O)C1(CC1)NS(=O)(=O)c1ccc(F)cc1F)C(C3)C2 |r,wU:9.10,TLB:8:3:29:9.7.6,1:3:9:29.5.6,10:9:29:3.4.30,THB:8:7:29:3.4.30,4:3:9:29.5.6,4:5:9:3.8.30,(8.62,-1.04,;7.53,-2.13,;7.93,-3.62,;6.04,-1.73,;5.15,-3.66,;3.94,-2.99,;3.96,-.59,;4.72,.58,;6.04,-.19,;3.38,-.19,;2.05,.58,;.72,-.19,;.72,-1.73,;-.62,.58,;.15,1.91,;-1.39,1.91,;-1.95,-.19,;-3.29,.58,;-2.52,1.91,;-4.06,-.76,;-4.62,1.35,;-4.62,2.89,;-5.95,3.66,;-7.29,2.89,;-8.62,3.66,;-7.29,1.35,;-5.95,.58,;-5.95,-.96,;3.38,-1.73,;2.55,-3.63,;4.72,-2.5,)| Show InChI InChI=1S/C21H25F2N3O4S/c22-14-1-2-16(15(23)7-14)31(29,30)26-21(3-4-21)19(28)25-17-12-5-11-6-13(17)10-20(8-11,9-12)18(24)27/h1-2,7,11-13,17,26H,3-6,8-10H2,(H2,24,27)(H,25,28)/t11?,12?,13?,17-,20?	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	79.1	n/a	n/a	n/a	n/a	6.0	25
AHN-GOOK PHARMACEUTICAL CO., LTD.; BAMICHEM CO., LTD; INCHEON UNIVERSITY INDUSTRY ACADEMIC COOPERATION FOUNDATION US Patent					Assay Description The inhibiting activity of 11β-HSD1 derived from microsomal fractions was measured using the HTRF assay (62CO2PEB, Cisbio). Different concentrat...				US Patent US9464044 (2016) BindingDB Entry DOI: 10.7270/Q2SJ1JH0
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