Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '11-beta-hydroxysteroid dehydrogenase 1' and Ligand = 'BDBM50239615'   

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))	BDBM50239615 (CHEMBL4095204) Show SMILES Fc1ccc(cc1)C1(CC(=O)N2CC(C2)C#N)C2CC3CC(C2)CC1C3 |TLB:25:24:22:18.19.20,8:7:18.25.19:23.21.22,4:7:22:18.19.20,THB:25:19:7.24.23:22,20:19:7:23.21.22,20:21:7:18.25.19,8:7:22:18.19.20,4:7:18.25.19:23.21.22,(54.09,-42.35,;54.11,-40.81,;52.78,-40.02,;52.8,-38.49,;54.14,-37.74,;55.46,-38.51,;55.45,-40.04,;54.16,-36.2,;53.02,-35.16,;51.55,-35.64,;50.3,-34.73,;51.06,-37.11,;49.69,-37.8,;50.39,-39.18,;51.77,-38.48,;49.91,-40.65,;49.43,-42.11,;55.36,-34.92,;56.68,-35.41,;58.08,-35.06,;58.1,-33.53,;56.69,-32.96,;55.35,-33.43,;55.65,-34.19,;55.65,-35.78,;57.07,-36.34,)| Show InChI InChI=1S/C22H25FN2O/c23-20-3-1-17(2-4-20)22(10-21(26)25-12-16(11-24)13-25)18-6-14-5-15(8-18)9-19(22)7-14/h1-4,14-16,18-19H,5-10,12-13H2	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	2	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Inhibition of 11beta-HSD1 in human microsomes using [3H]cortisone as substrate preincubated for 10 mins followed by substrate addition measured after...				J Med Chem 60: 4932-4948 (2017) Article DOI: 10.1021/acs.jmedchem.7b00211 BindingDB Entry DOI: 10.7270/Q2DV1N23
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Mus musculus (mouse))	BDBM50239615 (CHEMBL4095204) Show SMILES Fc1ccc(cc1)C1(CC(=O)N2CC(C2)C#N)C2CC3CC(C2)CC1C3 |TLB:25:24:22:18.19.20,8:7:18.25.19:23.21.22,4:7:22:18.19.20,THB:25:19:7.24.23:22,20:19:7:23.21.22,20:21:7:18.25.19,8:7:22:18.19.20,4:7:18.25.19:23.21.22,(54.09,-42.35,;54.11,-40.81,;52.78,-40.02,;52.8,-38.49,;54.14,-37.74,;55.46,-38.51,;55.45,-40.04,;54.16,-36.2,;53.02,-35.16,;51.55,-35.64,;50.3,-34.73,;51.06,-37.11,;49.69,-37.8,;50.39,-39.18,;51.77,-38.48,;49.91,-40.65,;49.43,-42.11,;55.36,-34.92,;56.68,-35.41,;58.08,-35.06,;58.1,-33.53,;56.69,-32.96,;55.35,-33.43,;55.65,-34.19,;55.65,-35.78,;57.07,-36.34,)| Show InChI InChI=1S/C22H25FN2O/c23-20-3-1-17(2-4-20)22(10-21(26)25-12-16(11-24)13-25)18-6-14-5-15(8-18)9-19(22)7-14/h1-4,14-16,18-19H,5-10,12-13H2	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	337	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Curated by ChEMBL					Assay Description Inhibition of mouse 11beta-HSD1				J Med Chem 60: 4932-4948 (2017) Article DOI: 10.1021/acs.jmedchem.7b00211 BindingDB Entry DOI: 10.7270/Q2DV1N23
					More data for this Ligand-Target Pair