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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 = 'BDBM50047067'   
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


(Homo sapiens (Human))		BDBM50047067
PNG
(4-[1-(4-Bromo-2-fluoro-benzyl)-5-fluoro-1H-benzoim...)
Show SMILES CC(C)(CC(O)=O)Cc1nc2cc(F)ccc2n1Cc1ccc(Br)cc1F
Show InChI InChI=1S/C20H19BrF2N2O2/c1-20(2,10-19(26)27)9-18-24-16-8-14(22)5-6-17(16)25(18)11-12-3-4-13(21)7-15(12)23/h3-8H,9-11H2,1-2H3,(H,26,27)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
PubMed
 15n/an/an/an/an/an/an/an/a



Carpibem

Curated by ChEMBL


Assay Description
Tested in vitro for inhibition constant against TXA2 / PGH-2 receptor using [125I]-PTA-OH binding affinity to human platelets

J Med Chem 36: 1175-87 (1993)


BindingDB Entry DOI: 10.7270/Q2R49PT8
More data for this
Ligand-Target Pair