Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '11-beta-hydroxysteroid dehydrogenase 1' and Ligand = 'BDBM250453'   

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))	BDBM250453 (US9464044, 50) Show SMILES Cn1ccc2cccc(c12)S(=O)(=O)NC1(CC1)C(=O)N[C@H]1C2CC3CC1CC(C3)(C2)C(N)=O |r,wU:20.22,TLB:29:27:24:20.21.22,30:27:20:24.23.22,19:20:24:27.28.26,THB:29:21:24:27.28.26,28:27:20:24.23.22,28:23:20:27.29.26,(-5.28,-2.02,;-6.37,-.93,;-7.9,-1.09,;-8.53,.32,;-7.38,1.35,;-7.38,2.89,;-6.05,3.66,;-4.71,2.89,;-4.71,1.35,;-6.05,.58,;-3.38,.58,;-2.61,1.91,;-4.15,-.76,;-2.05,-.19,;-.71,.58,;.06,1.91,;-1.48,1.91,;.62,-.19,;.62,-1.73,;1.95,.58,;3.29,-.19,;4.62,.58,;3.87,-.59,;3.85,-2.99,;2.45,-3.63,;3.29,-1.73,;4.62,-2.5,;5.95,-1.73,;5.05,-3.66,;5.95,-.19,;7.44,-2.13,;8.53,-1.04,;7.84,-3.62,)| Show InChI InChI=1S/C24H30N4O4S/c1-28-8-5-15-3-2-4-18(20(15)28)33(31,32)27-24(6-7-24)22(30)26-19-16-9-14-10-17(19)13-23(11-14,12-16)21(25)29/h2-5,8,14,16-17,19,27H,6-7,9-13H2,1H3,(H2,25,29)(H,26,30)/t14?,16?,17?,19-,23?	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.400	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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