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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Peroxisome proliferator-activated receptor gamma' and Ligand = 'BDBM50471952'   
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
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM50471952
PNG
(CHEMBL146369)
Show SMILES OC(=O)[C@H](Cc1ccc(OCC2CCc3ccccc3C2)cc1)Nc1ccccc1C(=O)c1ccccc1
Show InChI InChI=1S/C33H31NO4/c35-32(26-9-2-1-3-10-26)29-12-6-7-13-30(29)34-31(33(36)37)21-23-15-18-28(19-16-23)38-22-24-14-17-25-8-4-5-11-27(25)20-24/h1-13,15-16,18-19,24,31,34H,14,17,20-22H2,(H,36,37)/t24?,31-/m0/s1
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
145n/an/an/an/an/an/an/an/a



Glaxo Wellcome Research and Development

Curated by ChEMBL


Assay Description
Inhibition by 50% of in vitro binding to Peroxisome proliferator activated receptor gamma


J Med Chem 41: 5037-54 (1998)


Article DOI: 10.1021/jm980413z
BindingDB Entry DOI: 10.7270/Q2J38W9F
More data for this
Ligand-Target Pair