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BDBM50371165 CHEMBL236237

SMILES: OC(=O)Cc1ccn(c1)-c1ccc2OCCOc2c1

InChI Key: InChIKey=XGRZLIMFDQCOFG-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50371165   
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
Dehydrogenase/reductase SDR family member 9


(Rattus norvegicus)
BDBM50371165
PNG
(CHEMBL236237)
Show SMILES OC(=O)Cc1ccn(c1)-c1ccc2OCCOc2c1
Show InChI InChI=1S/C14H13NO4/c16-14(17)7-10-3-4-15(9-10)11-1-2-12-13(8-11)19-6-5-18-12/h1-4,8-9H,5-7H2,(H,16,17)
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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



Universitat de Barcelona

Curated by ChEMBL


Assay Description
Inhibition of rat liver 3-alpha-HSD assessed as 5-beta-dihydrocortisone reduction


Bioorg Med Chem 15: 4876-90 (2007)


Article DOI: 10.1016/j.bmc.2007.04.050
BindingDB Entry DOI: 10.7270/Q2VH5PN7
More data for this
Ligand-Target Pair