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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nuclear receptor subfamily 1 group D member 1' and Ligand = 'BDBM50388632'   
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
Nuclear receptor subfamily 1 group D member 1


(Homo sapiens)
BDBM50388632
PNG
(CHEMBL2059549)
Show SMILES CC(C)(C)OC(=O)CN(Cc1ccc(s1)[N+]([O-])=O)S(=O)(=O)c1cccc2ccccc12
Show InChI InChI=1S/C21H22N2O6S2/c1-21(2,3)29-20(24)14-22(13-16-11-12-19(30-16)23(25)26)31(27,28)18-10-6-8-15-7-4-5-9-17(15)18/h4-12H,13-14H2,1-3H3
PDB
MMDB

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Similars

Article
PubMed
n/an/an/an/a 800n/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Agonist activity at Rev-Erbalpha expressed in HEK293 cells coexpressing BamII promoter assessed as repression of transcription after 24 hrs by dual-G...


Bioorg Med Chem Lett 22: 4413-7 (2012)

More data for this
Ligand-Target Pair