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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 = 'BDBM50450250'   
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))		BDBM50450250
PNG
(CHEMBL4160620)
Show SMILES Cn1c(COc2cccc(c2)C(O)=O)nc2ccc(Oc3cc(F)cc(Cl)c3)cc12
Show InChI InChI=1S/C22H16ClFN2O4/c1-26-20-11-17(30-18-9-14(23)8-15(24)10-18)5-6-19(20)25-21(26)12-29-16-4-2-3-13(7-16)22(27)28/h2-11H,12H2,1H3,(H,27,28)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

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PC cid
PC sid
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Article
PubMed
n/an/an/an/a 23n/an/an/an/a



Daiichi Sankyo Co., Ltd.

Curated by ChEMBL


Assay Description
Agonist activity at recombinant human GAL4-DBD fused PPARgamma LBD expressed in COS7 cells after 24 hrs by luciferase reporter gene assay

Bioorg Med Chem 26: 5079-5098 (2018)


Article DOI: 10.1016/j.bmc.2018.09.006
BindingDB Entry DOI: 10.7270/Q2J968XC
More data for this
Ligand-Target Pair