Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '11-beta-hydroxysteroid dehydrogenase 1' and Ligand = 'BDBM167436'   

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))	BDBM167436 (US9073906, 60) Show SMILES NC(=O)C12CC3CC(C1)C(NC(=O)CN1CCCN(c4ccccc4)S1(=O)=O)C(C3)C2 |TLB:10:9:6:3.4.8,10:9:3.30.8:6.5.29,1:3:9:6.5.29,THB:30:3:6:9.28.29,30:28:6:3.4.8,4:3:9:6.5.29,4:5:9:3.30.8,(8.38,3.66,;7.61,2.32,;8.38,.99,;6.07,2.32,;5.45,3.73,;3.92,3.9,;3.01,2.66,;3.63,1.25,;5.16,1.08,;3.63,-.82,;2.29,-1.59,;.96,-.82,;.96,.72,;-.37,-1.59,;-1.71,-.82,;-1.71,.72,;-3.04,1.49,;-4.37,.72,;-4.37,-.82,;-5.71,-1.59,;-7.04,-.82,;-8.38,-1.59,;-8.38,-3.13,;-7.04,-3.9,;-5.71,-3.13,;-3.04,-1.59,;-2.27,-2.93,;-3.81,-2.93,;4.65,.33,;3.7,2.53,;6.02,.2,)| Show InChI InChI=1S/C22H30N4O4S/c23-21(28)22-11-15-9-16(12-22)20(17(10-15)13-22)24-19(27)14-25-7-4-8-26(31(25,29)30)18-5-2-1-3-6-18/h1-3,5-6,15-17,20H,4,7-14H2,(H2,23,28)(H,24,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY US Patent					Assay Description The in vitro inhibitory activities of the novel compounds to human 11β-HSD1 were evaluated in accordance with homogenous time-resolved fluoresce...				US Patent US9073906 (2015) BindingDB Entry DOI: 10.7270/Q2RV0MFB
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