Found 2 hits Enz. Inhib. hit(s) with Target = '11-beta-hydroxysteroid dehydrogenase 1' and Ligand = 'BDBM50112134' 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)) | BDBM50112134
(CHEMBL3609862)Show SMILES NC(=O)C12CC3CC(C1)[C@H](NS(=O)(=O)c1ccccc1F)C(C3)C2 |r,wD:9.10,TLB:8:3:22:6.7.9,10:9:22:23.4.3,THB:4:5:9:23.3.8,4:3:22.5.6:9,8:7:22:23.4.3,1:3:22:6.7.9,1:3:22.5.6:9,(3.58,2.29,;3.07,1.17,;3.79,.17,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1,2.05,;-.95,.32,;.56,-.22,;-2.19,-.22,;-3.39,-1.17,;-4.82,-.59,;-4.99,.63,;-3.85,.17,;-6.03,-1.55,;-5.81,-3.07,;-7.02,-4.02,;-8.45,-3.45,;-8.67,-1.93,;-7.46,-.97,;-7.63,.25,;-1.2,1.02,;-1.2,2.69,;.34,.44,)| Show InChI InChI=1S/C17H21FN2O3S/c18-13-3-1-2-4-14(13)24(22,23)20-15-11-5-10-6-12(15)9-17(7-10,8-11)16(19)21/h1-4,10-12,15,20H,5-9H2,(H2,19,21)/t10?,11?,12?,15-,17? | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 28 | n/a | n/a | n/a | n/a | n/a | n/a |
Incheon National University
Curated by ChEMBL
| Assay Description Inhibition of human 11beta-HSD1 |
Bioorg Med Chem Lett 25: 3501-6 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.099 BindingDB Entry DOI: 10.7270/Q2BP04KW |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50112134
(CHEMBL3609862)Show SMILES NC(=O)C12CC3CC(C1)[C@H](NS(=O)(=O)c1ccccc1F)C(C3)C2 |r,wD:9.10,TLB:8:3:22:6.7.9,10:9:22:23.4.3,THB:4:5:9:23.3.8,4:3:22.5.6:9,8:7:22:23.4.3,1:3:22:6.7.9,1:3:22.5.6:9,(3.58,2.29,;3.07,1.17,;3.79,.17,;1.56,1.02,;1.56,2.59,;.12,3.07,;-1,2.05,;-.95,.32,;.56,-.22,;-2.19,-.22,;-3.39,-1.17,;-4.82,-.59,;-4.99,.63,;-3.85,.17,;-6.03,-1.55,;-5.81,-3.07,;-7.02,-4.02,;-8.45,-3.45,;-8.67,-1.93,;-7.46,-.97,;-7.63,.25,;-1.2,1.02,;-1.2,2.69,;.34,.44,)| Show InChI InChI=1S/C17H21FN2O3S/c18-13-3-1-2-4-14(13)24(22,23)20-15-11-5-10-6-12(15)9-17(7-10,8-11)16(19)21/h1-4,10-12,15,20H,5-9H2,(H2,19,21)/t10?,11?,12?,15-,17? | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
| Article PubMed
| n/a | n/a | 244 | n/a | n/a | n/a | n/a | n/a | n/a |
Incheon National University
Curated by ChEMBL
| Assay Description Inhibition of mouse 11beta-HSD1 |
Bioorg Med Chem Lett 25: 3501-6 (2015)
Article DOI: 10.1016/j.bmcl.2015.06.099 BindingDB Entry DOI: 10.7270/Q2BP04KW |
More data for this Ligand-Target Pair | |