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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 = 'BDBM50090130'   
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))		BDBM50090130
PNG
(7-{(1R,2R,3R,5S)-2-[(R)-5-(3-Ethyl-phenyl)-3-hydro...)
Show SMILES CCc1cccc(CC[C@H](O)CC[C@H]2[C@H](O)C[C@H](O)[C@@H]2CCCCCCC(O)=O)c1
Show InChI InChI=1S/C25H40O5/c1-2-18-8-7-9-19(16-18)12-13-20(26)14-15-22-21(23(27)17-24(22)28)10-5-3-4-6-11-25(29)30/h7-9,16,20-24,26-28H,2-6,10-15,17H2,1H3,(H,29,30)/t20-,21+,22+,23-,24+/m0/s1
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PC cid
PC sid
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Similars
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Procter & Gamble Pharmaceuticals

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-46,619 from human TP-receptor expressed in CHO-KI cells

Bioorg Med Chem Lett 10: 1519-22 (2000)


BindingDB Entry DOI: 10.7270/Q28W3CJX
More data for this
Ligand-Target Pair