Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '11-beta-hydroxysteroid dehydrogenase 1' and Ligand = 'BDBM50430145'   

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))	BDBM50430145 (CHEMBL2338266) Show SMILES CC1(C)CN([C@H]2C3CC4CC2C[C@@](O)(C4)C3)C(=O)c2cnn(c2C1)-c1ccccc1 |r,wU:5.4,12.13,TLB:9:8:15:11.10.5,9:10:14.8.7:15,5:6:14:11.9.10,THB:5:10:14:7.6.15,4:5:14.8.7:15,(30.58,-17.72,;30.19,-19.21,;31.67,-18.81,;31.12,-20.44,;30.75,-21.94,;31.93,-22.93,;33.32,-22.33,;34.37,-23.56,;34.38,-25.15,;32.98,-25.72,;31.95,-24.46,;33.35,-24.79,;34.68,-24.29,;36.21,-24.27,;35.89,-25.55,;34.67,-22.8,;29.35,-22.57,;29.31,-24.11,;27.97,-21.87,;26.63,-22.62,;25.49,-21.59,;26.13,-20.18,;27.67,-20.35,;28.66,-19.17,;25.37,-18.85,;26.16,-17.52,;25.4,-16.18,;23.86,-16.16,;23.08,-17.5,;23.84,-18.84,)| Show InChI InChI=1S/C25H31N3O2/c1-24(2)13-21-20(14-26-28(21)19-6-4-3-5-7-19)23(29)27(15-24)22-17-8-16-9-18(22)12-25(30,10-16)11-17/h3-7,14,16-18,22,30H,8-13,15H2,1-2H3/t16?,17?,18?,22-,25+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.5	n/a	n/a	n/a	n/a	n/a	n/a
Toray Industries, Inc. Curated by ChEMBL					Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone and NADPH as substrate by HTRF assay				Bioorg Med Chem Lett 23: 1617-21 (2013) Article DOI: 10.1016/j.bmcl.2013.01.090 BindingDB Entry DOI: 10.7270/Q27P90RZ
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Mus musculus (mouse))	BDBM50430145 (CHEMBL2338266) Show SMILES CC1(C)CN([C@H]2C3CC4CC2C[C@@](O)(C4)C3)C(=O)c2cnn(c2C1)-c1ccccc1 |r,wU:5.4,12.13,TLB:9:8:15:11.10.5,9:10:14.8.7:15,5:6:14:11.9.10,THB:5:10:14:7.6.15,4:5:14.8.7:15,(30.58,-17.72,;30.19,-19.21,;31.67,-18.81,;31.12,-20.44,;30.75,-21.94,;31.93,-22.93,;33.32,-22.33,;34.37,-23.56,;34.38,-25.15,;32.98,-25.72,;31.95,-24.46,;33.35,-24.79,;34.68,-24.29,;36.21,-24.27,;35.89,-25.55,;34.67,-22.8,;29.35,-22.57,;29.31,-24.11,;27.97,-21.87,;26.63,-22.62,;25.49,-21.59,;26.13,-20.18,;27.67,-20.35,;28.66,-19.17,;25.37,-18.85,;26.16,-17.52,;25.4,-16.18,;23.86,-16.16,;23.08,-17.5,;23.84,-18.84,)| Show InChI InChI=1S/C25H31N3O2/c1-24(2)13-21-20(14-26-28(21)19-6-4-3-5-7-19)23(29)27(15-24)22-17-8-16-9-18(22)12-25(30,10-16)11-17/h3-7,14,16-18,22,30H,8-13,15H2,1-2H3/t16?,17?,18?,22-,25+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	39	n/a	n/a	n/a	n/a	n/a	n/a
Toray Industries, Inc. Curated by ChEMBL					Assay Description Inhibition of mouse 11beta-HSD1 expressed in HEK293 cells using cortisone and NADPH as substrate by HTRF assay				Bioorg Med Chem Lett 23: 1617-21 (2013) Article DOI: 10.1016/j.bmcl.2013.01.090 BindingDB Entry DOI: 10.7270/Q27P90RZ
					More data for this Ligand-Target Pair