BindingDB logo
myBDB logout

BDBM50339092 6-{Ethyl-[4-isopropyl-3-(3-phenylpropoxy)phenyl]amino}nicotinic acid::CHEMBL1688394

SMILES: CCN(c1ccc(C(C)C)c(OCCCc2ccccc2)c1)c1ccc(cn1)C(O)=O

InChI Key: InChIKey=NSJIEKPNKVMLGM-UHFFFAOYSA-N

Data: 1 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50339092   
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
Retinoic acid receptor RXR-alpha


(Homo sapiens (Human))
BDBM50339092
PNG
(6-{Ethyl-[4-isopropyl-3-(3-phenylpropoxy)phenyl]am...)
Show SMILES CCN(c1ccc(C(C)C)c(OCCCc2ccccc2)c1)c1ccc(cn1)C(O)=O
Show InChI InChI=1S/C26H30N2O3/c1-4-28(25-15-12-21(18-27-25)26(29)30)22-13-14-23(19(2)3)24(17-22)31-16-8-11-20-9-6-5-7-10-20/h5-7,9-10,12-15,17-19H,4,8,11,16H2,1-3H3,(H,29,30)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 820n/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