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SMILES: CN1c2ccc(NS(=O)(=O)c3ccccc3F)cc2N=C(c2ccc(cc2)C(O)=O)c2cc3c(cc12)C(C)(C)CCC3(C)C

InChI Key: InChIKey=DMNPRZRCWXJWCA-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50218467   
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))
BDBM50218467
PNG
(4-[2-(2-fluoro-benzenesulfonylamino)-5,7,7,10,10-p...)
Show SMILES CN1c2ccc(NS(=O)(=O)c3ccccc3F)cc2N=C(c2ccc(cc2)C(O)=O)c2cc3c(cc12)C(C)(C)CCC3(C)C |t:21|
Show InChI InChI=1S/C35H34FN3O4S/c1-34(2)16-17-35(3,4)26-20-30-24(19-25(26)34)32(21-10-12-22(13-11-21)33(40)41)37-28-18-23(14-15-29(28)39(30)5)38-44(42,43)31-9-7-6-8-27(31)36/h6-15,18-20,38H,16-17H2,1-5H3,(H,40,41)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 2.30E+3n/an/an/an/an/an/a



Tsukuba Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human RXRalpha expressed in EK293 cells assessed as inhibition of 9-cis-retinoic acid-induced transactivation


Bioorg Med Chem Lett 17: 4808-11 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.079
BindingDB Entry DOI: 10.7270/Q2V40TWB
More data for this
Ligand-Target Pair
Retinoic acid receptor RXR-alpha


(Homo sapiens (Human))
BDBM50218467
PNG
(4-[2-(2-fluoro-benzenesulfonylamino)-5,7,7,10,10-p...)
Show SMILES CN1c2ccc(NS(=O)(=O)c3ccccc3F)cc2N=C(c2ccc(cc2)C(O)=O)c2cc3c(cc12)C(C)(C)CCC3(C)C |t:21|
Show InChI InChI=1S/C35H34FN3O4S/c1-34(2)16-17-35(3,4)26-20-30-24(19-25(26)34)32(21-10-12-22(13-11-21)33(40)41)37-28-18-23(14-15-29(28)39(30)5)38-44(42,43)31-9-7-6-8-27(31)36/h6-15,18-20,38H,16-17H2,1-5H3,(H,40,41)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 4.40E+3n/an/an/an/an/an/a



Tsukuba Research Institute

Curated by ChEMBL


Assay Description
Antagonist activity at human RXRalpha expressed in EK293 cells assessed as inhibition of LG100268-induced transactivation


Bioorg Med Chem Lett 17: 4808-11 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.079
BindingDB Entry DOI: 10.7270/Q2V40TWB
More data for this
Ligand-Target Pair