BindingDB logo
myBDB logout

BDBM50027530 5,12-Dihydroxy-icosa-6,8,11,14-tetraenoic acid methyl ester(5,12-diHETE)::CHEMBL349755

SMILES: CCCCCCC=CC(=O)CC\C=C/C=C/C(O)CCCC(=O)OC

InChI Key: InChIKey=MQYDNBIUOXJPOA-VPCAVQNSNA-N

Data: 1 IC50

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 1 hit for monomerid = 50027530   
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
Arachidonate 5-lipoxygenase


(Homo sapiens (Human))
BDBM50027530
PNG
(5,12-Dihydroxy-icosa-6,8,11,14-tetraenoic acid met...)
Show SMILES CCCCCCC=CC(=O)CC\C=C/C=C/C(O)CCCC(=O)OC
Show InChI InChI=1/C21H34O4/c1-3-4-5-6-7-10-14-19(22)15-11-8-9-12-16-20(23)17-13-18-21(24)25-2/h8-10,12,14,16,20,23H,3-7,11,13,15,17-18H2,1-2H3/b9-8-,14-10+,16-12+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against 5-lipoxygenase


J Med Chem 26: 72-8 (1983)


Article DOI: 10.1021/jm00355a015
BindingDB Entry DOI: 10.7270/Q2WD3ZJQ
More data for this
Ligand-Target Pair