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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Thromboxane-A synthase' and Ligand = 'BDBM50037757'   
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)
BDBM50037757
PNG
(5-[1-(1-Imidazol-1-yl-2-phenyl-ethyl)-hept-(E)-yli...)
Show SMILES CCCCCC\C(=N/OCCCCC(O)=O)C(Cc1ccccc1)n1ccnc1
Show InChI InChI=1S/C23H33N3O3/c1-2-3-4-8-13-21(25-29-17-10-9-14-23(27)28)22(26-16-15-24-19-26)18-20-11-6-5-7-12-20/h5-7,11-12,15-16,19,22H,2-4,8-10,13-14,17-18H2,1H3,(H,27,28)/b25-21+
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PC cid
PC sid
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Similars

PubMed
n/an/a 50n/an/an/an/an/an/a



Pharmacia-Farmitalia Carlo Erba

Curated by ChEMBL


Assay Description
In vitro inhibition of thromboxane-A2 synthase in rat whole blood during clotting at 37 degrees centigrade


J Med Chem 37: 3588-604 (1994)


BindingDB Entry DOI: 10.7270/Q2C24VFD
More data for this
Ligand-Target Pair