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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 256.3
BDBM50025955

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))
BDBM50025955
PNG
(5-[5-(1H-Tetrazol-5-yl)-pentyl]-imidazo[1,5-a]pyri...)
Show SMILES C(CCc1nnn[nH]1)CCc1cccc2cncn12
Show InChI InChI=1S/C13H16N6/c1(3-8-13-15-17-18-16-13)2-5-11-6-4-7-12-9-14-10-19(11)12/h4,6-7,9-10H,1-3,5,8H2,(H,15,16,17,18)
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 19n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of thromboxane A2 synthetase from human platelets.


J Med Chem 28: 164-70 (1985)


BindingDB Entry DOI: 10.7270/Q22B8ZKX
More data for this
Ligand-Target Pair