Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '11-beta-hydroxysteroid dehydrogenase 1' and Ligand = 'BDBM186125'   

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))	BDBM186125 (US9163012, 42, Isomer 1 | US9163012, 42, Isomer 2) Show SMILES Cc1csc(n1)C1CCN(C1)C(=O)OC1C2CC3CC1CC(C3)(C2)C(N)=O |TLB:13:14:20:22.17.18,14:15:22:20.19.18,THB:14:19:22:15.16.23,16:15:20:22.17.18,16:17:20:15.14.23,(8.47,.53,;7.14,1.3,;7.14,2.84,;5.67,3.32,;4.77,2.07,;5.67,.83,;3.23,2.07,;2.32,3.32,;.86,2.84,;.86,1.3,;2.32,.83,;-.48,.53,;-.48,-1.01,;-1.81,1.3,;-3.14,.53,;-3.14,-1.01,;-4.04,-2.93,;-5.24,-2.27,;-5.23,.14,;-4.47,1.3,;-5.8,.53,;-5.8,-1.01,;-6.64,-2.91,;-4.47,-1.78,;-7.14,-1.78,;-8.47,-1.01,;-7.14,-3.32,)| Show InChI InChI=1S/C20H27N3O3S/c1-11-10-27-17(22-11)13-2-3-23(9-13)19(25)26-16-14-4-12-5-15(16)8-20(6-12,7-14)18(21)24/h10,12-16H,2-9H2,1H3,(H2,21,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.08	n/a	n/a	n/a	n/a	n/a	25
Vitae Pharmaceuticals, Inc. US Patent					Assay Description Inhibition of microsomal preparations of 11.beta.-HSDl by compounds of the present invention, as described essentially previously (K. Solly, SS Mundt...				US Patent US9163012 (2015) BindingDB Entry DOI: 10.7270/Q2TD9W45
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Homo sapiens (Human))	BDBM186125 (US9163012, 42, Isomer 1 | US9163012, 42, Isomer 2) Show SMILES Cc1csc(n1)C1CCN(C1)C(=O)OC1C2CC3CC1CC(C3)(C2)C(N)=O |TLB:13:14:20:22.17.18,14:15:22:20.19.18,THB:14:19:22:15.16.23,16:15:20:22.17.18,16:17:20:15.14.23,(8.47,.53,;7.14,1.3,;7.14,2.84,;5.67,3.32,;4.77,2.07,;5.67,.83,;3.23,2.07,;2.32,3.32,;.86,2.84,;.86,1.3,;2.32,.83,;-.48,.53,;-.48,-1.01,;-1.81,1.3,;-3.14,.53,;-3.14,-1.01,;-4.04,-2.93,;-5.24,-2.27,;-5.23,.14,;-4.47,1.3,;-5.8,.53,;-5.8,-1.01,;-6.64,-2.91,;-4.47,-1.78,;-7.14,-1.78,;-8.47,-1.01,;-7.14,-3.32,)| Show InChI InChI=1S/C20H27N3O3S/c1-11-10-27-17(22-11)13-2-3-23(9-13)19(25)26-16-14-4-12-5-15(16)8-20(6-12,7-14)18(21)24/h10,12-16H,2-9H2,1H3,(H2,21,24)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	>100	n/a	n/a	n/a	n/a	n/a	25
Vitae Pharmaceuticals, Inc. US Patent					Assay Description Inhibition of microsomal preparations of 11.beta.-HSDl by compounds of the present invention, as described essentially previously (K. Solly, SS Mundt...				US Patent US9163012 (2015) BindingDB Entry DOI: 10.7270/Q2TD9W45
					More data for this Ligand-Target Pair