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BDBM50269534 (8Z,11Z,14Z)-Icosatrienoic acid::(8Z,11Z,14Z)-icosa-8,11,14-trienoic acid::(Z,Z,Z)-8,11,14-Eicosatrienoate::(Z,Z,Z)-8,11,14-Eicosatrienoic acid::(Z,Z,Z)-8,11,14-Icosatrienoic acid::8,11,14-Eicosatrienoate::8,11,14-Eicosatrienoic Acid::8,11,14-Icosatrienoate::CHEMBL465183::DGLA::Dihomo-gamma-linolenic acid::Homo-gamma-linolenic acid::all-cis-icosa-8,11,14-trienoic acid::cis-8,11,14-eicosatrienoic acid::gamma-Homolinolenic acid

SMILES: CCCCC\C=C/C\C=C/C\C=C/CCCCCCC(O)=O

InChI Key: InChIKey=HOBAELRKJCKHQD-QNEBEIHSSA-N

Data: 1 KI  4 IC50

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 5 hits for monomerid = 50269534   
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
TG 1019


(HUMAN)
BDBM50269534
PNG
((8Z,11Z,14Z)-Icosatrienoic acid | (8Z,11Z,14Z)-ico...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/CCCCCCC(O)=O
Show InChI InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13H,2-5,8,11,14-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-
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Article
PubMed
3.70E+3n/an/an/an/an/an/an/an/a



Tanabe Seiyaku Co. Ltd.

Curated by PDSP Ki Database




J Biol Chem 277: 31459-65 (2002)

More data for this
Ligand-Target Pair
TG 1019


(HUMAN)
BDBM50269534
PNG
((8Z,11Z,14Z)-Icosatrienoic acid | (8Z,11Z,14Z)-ico...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/CCCCCCC(O)=O
Show InChI InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13H,2-5,8,11,14-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-
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Article
PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



McGill University

Curated by ChEMBL


Assay Description
Antagonist activity at human OXE receptor fused with G-alphai assessed as inhibition of 5-oxo-ETE-induced GTPgammaS binding after 60 mins by liquid s...


J Med Chem 57: 364-77 (2014)

More data for this
Ligand-Target Pair
Coagulation factor VII/tissue factor


(Homo sapiens)
BDBM50269534
PNG
((8Z,11Z,14Z)-Icosatrienoic acid | (8Z,11Z,14Z)-ico...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/CCCCCCC(O)=O
Show InChI InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13H,2-5,8,11,14-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-
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PubMed
n/an/a 3.00E+4n/an/an/an/an/an/a



Searle Discovery Research

Curated by ChEMBL


Assay Description
Inhibition of amidolytic activity of human tissue factor/human factor 7a


J Nat Prod 61: 1352-5 (1999)

More data for this
Ligand-Target Pair
Trypsin


(Sus scrofa)
BDBM50269534
PNG
((8Z,11Z,14Z)-Icosatrienoic acid | (8Z,11Z,14Z)-ico...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/CCCCCCC(O)=O
Show InChI InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13H,2-5,8,11,14-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-
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Article
PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Searle Discovery Research

Curated by ChEMBL


Assay Description
Inhibition of pig pancreatic trypsin after 15 mins


J Nat Prod 61: 1352-5 (1999)

More data for this
Ligand-Target Pair
Coagulation factor VII/tissue factor


(Homo sapiens)
BDBM50269534
PNG
((8Z,11Z,14Z)-Icosatrienoic acid | (8Z,11Z,14Z)-ico...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/CCCCCCC(O)=O
Show InChI InChI=1S/C20H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22/h6-7,9-10,12-13H,2-5,8,11,14-19H2,1H3,(H,21,22)/b7-6-,10-9-,13-12-
PDB
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KEGG

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Article
PubMed
n/an/a 7.50E+4n/an/an/an/an/an/a



Searle Discovery Research

Curated by ChEMBL


Assay Description
Inhibition of amidolytic activity of human tissue factor/human factor 7a


J Nat Prod 61: 1352-5 (1999)

More data for this
Ligand-Target Pair