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SMILES: CCOC(=O)CCCCO\N=C(\c1cccnc1)c1ccccc1C(=O)N1CCN(CC1)C(=O)C1CSC(N1)c1cccnc1

InChI Key: InChIKey=IZEPJYDBAXVTOT-ONQIKCEGSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50109133   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Thromboxane-A synthase


(Homo sapiens (Human))		BDBM50109133
PNG
(5-[1-Pyridin-3-yl-1-{2-[4-(2-pyridin-3-yl-thiazoli...)
Show SMILES CCOC(=O)CCCCO\N=C(\c1cccnc1)c1ccccc1C(=O)N1CCN(CC1)C(=O)C1CSC(N1)c1cccnc1
Show InChI InChI=1S/C33H38N6O5S/c1-2-43-29(40)13-5-6-20-44-37-30(24-9-7-14-34-21-24)26-11-3-4-12-27(26)32(41)38-16-18-39(19-17-38)33(42)28-23-45-31(36-28)25-10-8-15-35-22-25/h3-4,7-12,14-15,21-22,28,31,36H,2,5-6,13,16-20,23H2,1H3/b37-30-
KEGG

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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 TXB2 production by incubating prostaglandin H2 with human platelet microsomes.

Bioorg Med Chem Lett 12: 341-4 (2002)


BindingDB Entry DOI: 10.7270/Q2ST7P56
More data for this
Ligand-Target Pair