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Target
Peroxisome proliferator-activated receptor gamma
Ligand
BDBM50264371
Substrate
n/a
Meas. Tech.
ChEMBL_538924 (CHEMBL1033969)
IC50
44000±n/a nM
Citation
 Markt, P; Petersen, RK; Flindt, EN; Kristiansen, K; Kirchmair, J; Spitzer, G; Distinto, S; Schuster, D; Wolber, G; Laggner, C; Langer, T Discovery of novel PPAR ligands by a virtual screening approach based on pharmacophore modeling, 3D shape, and electrostatic similarity screening. J Med Chem 51:6303-17 (2008) [PubMed]  Article 
Target
Name:
Peroxisome proliferator-activated receptor gamma
Synonyms:
NR1C3 | Nuclear receptor subfamily 1 group C member 3 | PPAR-gamma | PPARG | PPARG_HUMAN | Peroxisome proliferator-activated receptor | Peroxisome proliferator-activated receptor gamma (PPAR gamma) | Peroxisome proliferator-activated receptor gamma (PPARG) | Peroxisome proliferator-activated receptor gamma (PPARĪ³) | Peroxisome proliferator-activated receptor gamma/Nuclear receptor corepressor 2 | peroxisome proliferator-activated receptor gamma isoform 2
Type:
Nuclear Receptor
Mol. Mass.:
57613.46
Organism:
Homo sapiens (Human)
Description:
P37231
Residue:
505
Sequence:
MGETLGDSPIDPESDSFTDTLSANISQEMTMVDTEMPFWPTNFGISSVDLSVMEDHSHSFDIKPFTTVDFSSISTPHYEDIPFTRTDPVVADYKYDLKLQEYQSAIKVEPASPPYYSEKTQLYNKPHEEPSNSLMAIECRVCGDKASGFHYGVHACEGCKGFFRRTIRLKLIYDRCDLNCRIHKKSRNKCQYCRFQKCLAVGMSHNAIRFGRMPQAEKEKLLAEISSDIDQLNPESADLRALAKHLYDSYIKSFPLTKAKARAILTGKTTDKSPFVIYDMNSLMMGEDKIKFKHITPLQEQSKEVAIRIFQGCQFRSVEAVQEITEYAKSIPGFVNLDLNDQVTLLKYGVHEIIYTMLASLMNKDGVLISEGQGFMTREFLKSLRKPFGDFMEPKFEFAVKFNALELDDSDLAIFIAVIILSGDRPGLLNVKPIEDIQDNLLQALELQLKLNHPESSQLFAKLLQKMTDLRQIVTEHVQLLQVIKKTETDMSLHPLLQEIYKDLY
  
Inhibitor
Name:
BDBM50264371
Synonyms:
(S)-ethyl 3-(2-(1-(2-chloro-6-fluorobenzoyl)piperidin-4-yl)thiazole-4-carboxamido)butanoate | CHEMBL489597
Type:
Small organic molecule
Emp. Form.:
C22H25ClFN3O4S
Mol. Mass.:
481.968
SMILES:
CCOC(=O)C[C@H](C)NC(=O)c1csc(n1)C1CCN(CC1)C(=O)c1c(F)cccc1Cl |r|
Structure:
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