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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 = 'BDBM50047267'   
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))
BDBM50047267
PNG
(2-{3-[2-(3-Hydroxy-propyl)-benzyl]-7-oxa-bicyclo[2...)
Show SMILES OCCCc1ccccc1CC1C2CCC(O2)C1c1nc(co1)C(=O)NCCCCC1CCCCC1 |TLB:10:11:16:14.13,THB:18:17:16:14.13|
Show InChI InChI=1S/C30H42N2O4/c33-18-8-14-22-12-4-5-13-23(22)19-24-26-15-16-27(36-26)28(24)30-32-25(20-35-30)29(34)31-17-7-6-11-21-9-2-1-3-10-21/h4-5,12-13,20-21,24,26-28,33H,1-3,6-11,14-19H2,(H,31,34)
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PC cid
PC sid
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Similars

PubMed
n/an/an/a 112n/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibitory binding activity against TXA2 receptor in human platelet membrane, using [3H]-SQ 29548 as the radioligand


J Med Chem 36: 1401-17 (1993)


BindingDB Entry DOI: 10.7270/Q2TX3DF9
More data for this
Ligand-Target Pair