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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Thromboxane A2 receptor' and Ligand = 'BDBM50282142'   
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 A2 receptor


(RAT)		BDBM50282142
PNG
(3-[(2-Benzoylamino-acetylamino)-methyl]-6-isopropy...)
Show SMILES CC(C)c1ccc2c(CNC(=O)CNC(=O)c3ccccc3)cc(C(O)=O)c2cc1
Show InChI InChI=1S/C24H24N2O4/c1-15(2)16-8-10-19-18(12-21(24(29)30)20(19)11-9-16)13-25-22(27)14-26-23(28)17-6-4-3-5-7-17/h3-12,15H,13-14H2,1-2H3,(H,25,27)(H,26,28)(H,29,30)
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PC cid
PC sid
UniChem

Similars
Article
n/an/a>1.00E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for antagonistic activity on isolated rat thoracic aorta (TXA2 receptor) precontracted by U-46619 (3 x 10 e-8 M)

Bioorg Med Chem Lett 3: 1687-1692 (1993)


Article DOI: 10.1016/S0960-894X(00)80043-8
BindingDB Entry DOI: 10.7270/Q2H70FQG
More data for this
Ligand-Target Pair