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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 283.7
BDBM50024410

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


(Rattus norvegicus)
BDBM50024410
PNG
(5-Chloro-thiophene-2-carboxylic acid (4-imidazol-1...)
Show SMILES Clc1ccc(s1)C(=O)NCCCCn1ccnc1
Show InChI InChI=1S/C12H14ClN3OS/c13-11-4-3-10(18-11)12(17)15-5-1-2-7-16-8-6-14-9-16/h3-4,6,8-9H,1-2,5,7H2,(H,15,17)
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KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 200n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of thromboxane formation at a concentration of 10e -6 M.


J Med Chem 30: 1036-40 (1987)


BindingDB Entry DOI: 10.7270/Q24F1PRV
More data for this
Ligand-Target Pair