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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Palmitoyl-CoA oxidase' and Ligand = 'BDBM50138600'   
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
Palmitoyl-CoA oxidase


(Rattus norvegicus)
BDBM50138600
PNG
(CHEMBL152941 | N-Benzo[1,2,5]thiadiazol-4-yl-2-{4-...)
Show SMILES Cc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)Nc4cccc5nsnc45)CC3)ccc2s1
Show InChI InChI=1S/C23H26N6O3S2/c1-15-24-20-11-17(5-6-21(20)33-15)32-14-16(30)12-28-7-9-29(10-8-28)13-22(31)25-18-3-2-4-19-23(18)27-34-26-19/h2-6,11,16,30H,7-10,12-14H2,1H3,(H,25,31)/t16-/m1/s1
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PC cid
PC sid
UniChem
PubMed
n/an/a 5.70E+3n/an/an/an/an/an/a



CV Therapeutics

Curated by ChEMBL


Assay Description
Inhibitory activity against Palmitoyl-CoA oxidase to inhibit rat heart mitochondrial Palmitoyl-CoA oxidation.


Bioorg Med Chem Lett 14: 549-52 (2003)

More data for this
Ligand-Target Pair