Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '11-beta-hydroxysteroid dehydrogenase 1' and Ligand = 'BDBM50329308'   

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))	BDBM50329308 ((R)-3-(5-Trifluoromethyl-[1,3,4]thiadiazol-2-ylami...) Show SMILES NC(=O)[C@@]12CC3CC(C1)[C@H](OC(=O)N1CC[C@H](C1)Nc1nnc(s1)C(F)(F)F)C(C3)C2 |r,wU:16.19,9.10,wD:3.2,TLB:6:5:30:8.7.9,6:7:4.5.29:30,THB:9:7:4:29.28.30,9:28:4:8.6.7,10:9:4.5.29:30,(-10.21,-23.19,;-8.86,-22.42,;-8.86,-20.88,;-7.52,-23.19,;-8.72,-24.47,;-7.22,-24.05,;-5.81,-24.61,;-4.8,-23.34,;-6.19,-23.68,;-4.79,-21.81,;-3.44,-21.05,;-2.12,-21.83,;-2.13,-23.37,;-.78,-21.08,;-.75,-19.53,;.72,-19.08,;1.61,-20.34,;.68,-21.57,;3.15,-20.36,;3.94,-19.04,;3.33,-17.62,;4.49,-16.61,;5.81,-17.4,;5.47,-18.9,;7.23,-16.8,;8.46,-17.72,;7.42,-15.27,;8.56,-16.01,;-6.18,-21.23,;-7.22,-22.47,;-7.53,-21.71,)| Show InChI InChI=1S/C19H24F3N5O3S/c20-19(21,22)15-25-26-16(31-15)24-12-1-2-27(8-12)17(29)30-13-10-3-9-4-11(13)7-18(5-9,6-10)14(23)28/h9-13H,1-8H2,(H2,23,28)(H,24,26)/t9?,10?,11?,12-,13-,18-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	21.3	n/a	n/a	n/a	n/a	n/a	n/a
Vitae Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of recombinant 11betaHSD1 expressed in CHO cells assessed as [3H]-cortisone to [3H]-cortisol by microscintillation plate reader				Bioorg Med Chem Lett 20: 6725-9 (2010) Article DOI: 10.1016/j.bmcl.2010.08.142 BindingDB Entry DOI: 10.7270/Q2X92BJ5
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Homo sapiens (Human))	BDBM50329308 ((R)-3-(5-Trifluoromethyl-[1,3,4]thiadiazol-2-ylami...) Show SMILES NC(=O)[C@@]12CC3CC(C1)[C@H](OC(=O)N1CC[C@H](C1)Nc1nnc(s1)C(F)(F)F)C(C3)C2 |r,wU:16.19,9.10,wD:3.2,TLB:6:5:30:8.7.9,6:7:4.5.29:30,THB:9:7:4:29.28.30,9:28:4:8.6.7,10:9:4.5.29:30,(-10.21,-23.19,;-8.86,-22.42,;-8.86,-20.88,;-7.52,-23.19,;-8.72,-24.47,;-7.22,-24.05,;-5.81,-24.61,;-4.8,-23.34,;-6.19,-23.68,;-4.79,-21.81,;-3.44,-21.05,;-2.12,-21.83,;-2.13,-23.37,;-.78,-21.08,;-.75,-19.53,;.72,-19.08,;1.61,-20.34,;.68,-21.57,;3.15,-20.36,;3.94,-19.04,;3.33,-17.62,;4.49,-16.61,;5.81,-17.4,;5.47,-18.9,;7.23,-16.8,;8.46,-17.72,;7.42,-15.27,;8.56,-16.01,;-6.18,-21.23,;-7.22,-22.47,;-7.53,-21.71,)| Show InChI InChI=1S/C19H24F3N5O3S/c20-19(21,22)15-25-26-16(31-15)24-12-1-2-27(8-12)17(29)30-13-10-3-9-4-11(13)7-18(5-9,6-10)14(23)28/h9-13H,1-8H2,(H2,23,28)(H,24,26)/t9?,10?,11?,12-,13-,18-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	>100	n/a	n/a	n/a	n/a	n/a	n/a
Vitae Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of 11betaHSD1 in human platelet assessed as [3H]-cortisone to [3H]-cortisol by microscintillation plate reader				Bioorg Med Chem Lett 20: 6725-9 (2010) Article DOI: 10.1016/j.bmcl.2010.08.142 BindingDB Entry DOI: 10.7270/Q2X92BJ5
					More data for this Ligand-Target Pair