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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '11-beta-hydroxysteroid dehydrogenase 1' and Ligand = 'BDBM50054696'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50054696
PNG
(CHEMBL3318972)
Show SMILES Cc1ncccc1Oc1cccn2c(nnc12)C1(CC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C21H17ClN4O/c1-14-17(4-2-12-23-14)27-18-5-3-13-26-19(18)24-25-20(26)21(10-11-21)15-6-8-16(22)9-7-15/h2-9,12-13H,10-11H2,1H3
PDB
MMDB

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Similars

Article
PubMed
n/an/a 5.5n/an/an/an/an/an/a



Bristol-Myers Squibb

Curated by ChEMBL


Assay Description
Inhibition of human recombinant 11beta-HSD-1 expressed in HEK293 EBNA cells using [3H]-cortisone and NADPH by scintillation proximity assay


ACS Med Chem Lett 5: 803-8 (2014)


Article DOI: 10.1021/ml500144h
BindingDB Entry DOI: 10.7270/Q2N0186W
More data for this
Ligand-Target Pair