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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 = 'BDBM50110454'   
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))		BDBM50110454
PNG
(5-[(2-[1,4-dimethyl-6-(2-chloro-phenyl)-7,8,9,10-t...)
Show SMILES CCOC(=O)CCCCO\N=C(\c1cccnc1)c1ccccc1C(=O)N1CCc2c(C1)sc-1c2C(=NC(C)c2nnc(C)n-12)c1ccccc1Cl |c:39|
Show InChI InChI=1S/C39H38ClN7O4S/c1-4-50-33(48)17-9-10-21-51-45-35(26-12-11-19-41-22-26)27-13-5-6-14-28(27)38(49)46-20-18-30-32(23-46)52-39-34(30)36(29-15-7-8-16-31(29)40)42-24(2)37-44-43-25(3)47(37)39/h5-8,11-16,19,22,24H,4,9-10,17-18,20-21,23H2,1-3H3/b45-35-
KEGG

UniProtKB/SwissProt

DrugBank
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GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
n/an/a>1.00E+3n/an/an/an/an/an/a



Nikken Chemicals Co., Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of thromboxane synthase (TXA2) in human platelet microsomes [reduced formation of TXB2 from prostaglandin H2(PGH2)]

Bioorg Med Chem Lett 12: 771-4 (2002)


BindingDB Entry DOI: 10.7270/Q23X85ZH
More data for this
Ligand-Target Pair