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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Retinoic acid receptor RXR-alpha' and Ligand = 'BDBM50502778'   
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
Retinoic acid receptor RXR-alpha


(Homo sapiens (Human))
BDBM50502778
PNG
(CHEMBL4583953)
Show SMILES Cc1cc(cc(c1)C(C)(C)C)-c1ccc(cc1)C(O)=O
Show InChI InChI=1S/C18H20O2/c1-12-9-15(11-16(10-12)18(2,3)4)13-5-7-14(8-6-13)17(19)20/h5-11H,1-4H3,(H,19,20)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 8.00E+3n/an/an/an/a



Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Agonist activity at Gal4-LBD fused RXRalpha (unknown origin) expressed in HEK293T cells after 14 to 16 hrs by dual-Glo luciferase assay


ACS Med Chem Lett 10: 1346-1352 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00306
BindingDB Entry DOI: 10.7270/Q2TQ64T0
More data for this
Ligand-Target Pair