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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 50034766   
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-A synthase


(Homo sapiens (Human))		BDBM50034766
PNG
((Z)-2-[(2S,4S,5R)-5-((Z)-5-Carboxy-pent-2-enyl)-4-...)
Show SMILES OC(=O)CC\C=C/C[C@@H]1CO[C@@H](O[C@@H]1c1ccccc1O)C(CCC\C=C(\c1ccccc1)c1cccnc1)C(O)=O
Show InChI InChI=1S/C34H37NO7/c36-30-19-10-9-17-28(30)32-26(14-5-2-6-20-31(37)38)23-41-34(42-32)29(33(39)40)18-8-7-16-27(24-12-3-1-4-13-24)25-15-11-21-35-22-25/h1-5,9-13,15-17,19,21-22,26,29,32,34,36H,6-8,14,18,20,23H2,(H,37,38)(H,39,40)/b5-2-,27-16-/t26-,29?,32+,34+/m1/s1
KEGG

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PC cid
PC sid
UniChem

Similars
PubMed
n/an/a 40n/an/an/an/an/an/a



ZENECA Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against human microsomal thromboxane synthase.

J Med Chem 38: 1608-28 (1995)


BindingDB Entry DOI: 10.7270/Q2319TWW
More data for this
Ligand-Target Pair