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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 323.4
BDBM50026485

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Thromboxane-A synthase


(Homo sapiens (Human))
BDBM50026485
PNG
(10-Phenyl-7-pyridin-3-yl-dec-6-enoic acid | CHEMBL...)
Show SMILES OC(=O)CCCC\C=C(\CCCc1ccccc1)c1cccnc1
Show InChI InChI=1S/C21H25NO2/c23-21(24)15-6-2-5-12-19(20-14-8-16-22-17-20)13-7-11-18-9-3-1-4-10-18/h1,3-4,8-10,12,14,16-17H,2,5-7,11,13,15H2,(H,23,24)/b19-12-
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 65n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against thromboxane B2 formation (TXA2 synthase) by incubating prostaglandin H2 (PGH-2) with horse platelet microsomes


J Med Chem 28: 287-94 (1985)


BindingDB Entry DOI: 10.7270/Q2P26ZPB
More data for this
Ligand-Target Pair