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SMILES: CCCC(=O)OCC(COC(=O)CCC)OC(=O)CCC

InChI Key: InChIKey=UYXTWWCETRIEDR-UHFFFAOYSA-N

PDB links: 1 PDB ID matches this monomer.

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50212744   
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
Pancreatic triacylglycerol lipase


(Homo sapiens (Human))
BDBM50212744
PNG
(CHEBI:35020 | TRIBUTYRIN)
Show SMILES CCCC(=O)OCC(COC(=O)CCC)OC(=O)CCC
Show InChI InChI=1S/C15H26O6/c1-4-7-13(16)19-10-12(21-15(18)9-6-3)11-20-14(17)8-5-2/h12H,4-11H2,1-3H3
PDB
MMDB

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MCE
KEGG
PC cid
PC sid
PDB
UniChem

Similars

<1n/an/an/an/an/an/an/an/a


TBA

Assay Description
Tested for hydrolysis with 0.2 ug/mL of PPL (porcine pancreatic lipase), 1.5 ug/mL of colipase and 4 mM sodium taurodeoxycholatet (NaTDC) at a compou...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2B56MWT
More data for this
Ligand-Target Pair
Pancreatic triacylglycerol lipase


(Homo sapiens (Human))
BDBM50212744
PNG
(CHEBI:35020 | TRIBUTYRIN)
Show SMILES CCCC(=O)OCC(COC(=O)CCC)OC(=O)CCC
Show InChI InChI=1S/C15H26O6/c1-4-7-13(16)19-10-12(21-15(18)9-6-3)11-20-14(17)8-5-2/h12H,4-11H2,1-3H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
KEGG
PC cid
PC sid
PDB
UniChem

Similars

1.10E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Tested for hydrolysis with 0.2 ug/mL of PPL (porcine pancreatic lipase) at a compound dose of 0.2 g


Citation and Details

BindingDB Entry DOI: 10.7270/Q2B56MWT
More data for this
Ligand-Target Pair