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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 = 'BDBM50339091'   
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))		BDBM50339091
PNG
(6-[Ethyl-(4-isopropyl-3-phenethyloxyphenyl)amino]n...)
Show SMILES CCN(c1ccc(C(C)C)c(OCCc2ccccc2)c1)c1ccc(cn1)C(O)=O
Show InChI InChI=1S/C25H28N2O3/c1-4-27(24-13-10-20(17-26-24)25(28)29)21-11-12-22(18(2)3)23(16-21)30-15-14-19-8-6-5-7-9-19/h5-13,16-18H,4,14-15H2,1-3H3,(H,28,29)
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Similars
Article
PubMed
n/an/an/an/a 330n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Agonist activity at RXRalpha transfected in human COS1 cells after 18 hrs by luciferase reporter gene transactivation assay

ACS Med Chem Lett 1: 521-525 (2010)


Article DOI: 10.1021/ml100184k
BindingDB Entry DOI: 10.7270/Q28S4Q6X
More data for this
Ligand-Target Pair