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SMILES: CCC(C1CCc2cc(OCCc3nc(oc3C)-c3cc(C)on3)ccc12)C(O)=O

InChI Key: InChIKey=DZEBXLFVYQEPOX-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50176613   
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 gamma


(Homo sapiens (Human))
BDBM50176613
PNG
(2-(5-(2-(5-methyl-2-(5-methylisoxazol-3-yl)oxazol-...)
Show SMILES CCC(C1CCc2cc(OCCc3nc(oc3C)-c3cc(C)on3)ccc12)C(O)=O
Show InChI InChI=1S/C23H26N2O5/c1-4-17(23(26)27)19-7-5-15-12-16(6-8-18(15)19)28-10-9-20-14(3)29-22(24-20)21-11-13(2)30-25-21/h6,8,11-12,17,19H,4-5,7,9-10H2,1-3H3,(H,26,27)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 762n/an/an/an/a



Bayer Research Center

Curated by ChEMBL


Assay Description
Activity against PPAR gamma in human by FRET assay


Bioorg Med Chem Lett 16: 297-301 (2005)


Article DOI: 10.1016/j.bmcl.2005.10.008
BindingDB Entry DOI: 10.7270/Q28P6025
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))
BDBM50176613
PNG
(2-(5-(2-(5-methyl-2-(5-methylisoxazol-3-yl)oxazol-...)
Show SMILES CCC(C1CCc2cc(OCCc3nc(oc3C)-c3cc(C)on3)ccc12)C(O)=O
Show InChI InChI=1S/C23H26N2O5/c1-4-17(23(26)27)19-7-5-15-12-16(6-8-18(15)19)28-10-9-20-14(3)29-22(24-20)21-11-13(2)30-25-21/h6,8,11-12,17,19H,4-5,7,9-10H2,1-3H3,(H,26,27)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 827n/an/an/an/a



Bayer Research Center

Curated by ChEMBL


Assay Description
Activity against PPAR alpha in human by FRET assay


Bioorg Med Chem Lett 16: 297-301 (2005)


Article DOI: 10.1016/j.bmcl.2005.10.008
BindingDB Entry DOI: 10.7270/Q28P6025
More data for this
Ligand-Target Pair