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2 similar compounds to monomer 50232174

Compile data set for download or QSAR
Wt: 476.5
BDBM50232212
Wt: 480.9
BDBM50232213

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50232212,50232213   
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
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50232213
PNG
(CHEMBL4069460)
Show SMILES CCCc1nc2ccc(cc2n1Cc1ccc(cc1)-c1ccccc1C(O)=O)-c1ccccc1Cl
Show InChI InChI=1S/C30H25ClN2O2/c1-2-7-29-32-27-17-16-22(24-9-5-6-11-26(24)31)18-28(27)33(29)19-20-12-14-21(15-13-20)23-8-3-4-10-25(23)30(34)35/h3-6,8-18H,2,7,19H2,1H3,(H,34,35)
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.39E+3n/an/an/an/a



University of Innsbruck

Curated by ChEMBL


Assay Description
Transactivation of Gal4 fused human PPARgamma LBD expressed in African green monkey COS7 cells after 42 hrs by dual luciferase reporter gene assay


Eur J Med Chem 126: 590-603 (2017)


Article DOI: 10.1016/j.ejmech.2016.11.051
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM50232212
PNG
(CHEMBL4086261)
Show SMILES CCCc1nc2ccc(cc2n1Cc1ccc(cc1)-c1ccccc1C(O)=O)-c1cccc(OC)c1
Show InChI InChI=1S/C31H28N2O3/c1-3-7-30-32-28-17-16-24(23-8-6-9-25(18-23)36-2)19-29(28)33(30)20-21-12-14-22(15-13-21)26-10-4-5-11-27(26)31(34)35/h4-6,8-19H,3,7,20H2,1-2H3,(H,34,35)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.35E+3n/an/an/an/a



University of Innsbruck

Curated by ChEMBL


Assay Description
Transactivation of Gal4 fused human PPARgamma LBD expressed in African green monkey COS7 cells after 42 hrs by dual luciferase reporter gene assay


Eur J Med Chem 126: 590-603 (2017)


Article DOI: 10.1016/j.ejmech.2016.11.051
More data for this
Ligand-Target Pair