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BDBM50463280 CHEMBL4249571

SMILES: Cc1cc(S[C@H](Cc2ccccc2)c2ccc(cc2)-c2ccc(cc2)C(F)(F)F)ccc1OCC(O)=O

InChI Key: InChIKey=NDMVMGJRCVLXQH-MUUNZHRXSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50463280   
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))		BDBM50463280
PNG
(CHEMBL4249571)
Show SMILES Cc1cc(S[C@H](Cc2ccccc2)c2ccc(cc2)-c2ccc(cc2)C(F)(F)F)ccc1OCC(O)=O |r|
Show InChI InChI=1S/C30H25F3O3S/c1-20-17-26(15-16-27(20)36-19-29(34)35)37-28(18-21-5-3-2-4-6-21)24-9-7-22(8-10-24)23-11-13-25(14-12-23)30(31,32)33/h2-17,28H,18-19H2,1H3,(H,34,35)/t28-/m1/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

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PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 0.700n/an/an/an/a



Daegu-Gyeongbuk Medical Innovation Foundation

Curated by ChEMBL


Assay Description
Transactivation of human PPARdelta expressed in monkey CV-1 cells coexpressing TK-PPRE-Luc after 24 hrs by luciferase reporter gene assay

Bioorg Med Chem 26: 4382-4389 (2018)


Article DOI: 10.1016/j.bmc.2018.06.044
BindingDB Entry DOI: 10.7270/Q2DJ5J8Z
More data for this
Ligand-Target Pair