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BDBM50145468 CHEMBL3764521

SMILES: CC(C)[C@@H]1CC[C@H](CO)[C@]11CC[C@@](C)(O)[C@@H](O)C1

InChI Key: InChIKey=OTTDIBJIEXQHKJ-GZBLMMOJSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50145468   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM50145468
PNG
(CHEMBL3764521)
Show SMILES CC(C)[C@@H]1CC[C@H](CO)[C@]11CC[C@@](C)(O)[C@@H](O)C1 |r|
Show InChI InChI=1S/C15H28O3/c1-10(2)12-5-4-11(9-16)15(12)7-6-14(3,18)13(17)8-15/h10-13,16-18H,4-9H2,1-3H3/t11-,12+,13+,14-,15-/m1/s1
PDB
MMDB

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PubMed
n/an/a>1.00E+6n/an/an/an/an/an/a



St. Jude Children's Research Hospital

Curated by ChEMBL


Assay Description
Inhibition of 11beta-HSD1 (unknown origin) using cortisol as substrate assessed as NADPH formation by fluorescent plate reader analysis


Eur J Med Chem 110: 126-32 (2016)


BindingDB Entry DOI: 10.7270/Q28P62DG
More data for this
Ligand-Target Pair