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SMILES: OC(=O)CCC\C=C/C[C@@H]1C2CCC(C2)[C@@H]1c1cccnc1

InChI Key: InChIKey=UZUUXEYJDKQWLL-ZLPFPMHRSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50008800   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Thromboxane-A synthase


(Homo sapiens (Human))
BDBM50008800
PNG
(7-(3-Pyridin-3-yl-bicyclo[2.2.1]hept-2-yl)-hept-5-...)
Show SMILES OC(=O)CCC\C=C/C[C@@H]1C2CCC(C2)[C@@H]1c1cccnc1 |THB:8:9:14:12.11|
Show InChI InChI=1S/C19H25NO2/c21-18(22)8-4-2-1-3-7-17-14-9-10-15(12-14)19(17)16-6-5-11-20-13-16/h1,3,5-6,11,13-15,17,19H,2,4,7-10,12H2,(H,21,22)/b3-1-/t14?,15?,17-,19-/m1/s1
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
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PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 50n/an/an/an/an/an/a



CIBA-GEIGY Corporation

Curated by ChEMBL


Assay Description
In vitro inhibition of thromboxane synthase using [14C]-arachidonic acid


J Med Chem 34: 1790-7 (1991)


BindingDB Entry DOI: 10.7270/Q2BR8R47
More data for this
Ligand-Target Pair