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BDBM50138627 2-{4-[(R)-2-Hydroxy-3-(2-methyl-benzothiazol-5-yloxy)-propyl]-piperazin-1-yl}-N-(3-phenoxy-phenyl)-acetamide::CHEMBL152932

SMILES: Cc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)Nc4cccc(Oc5ccccc5)c4)CC3)ccc2s1

InChI Key: InChIKey=BCKICEBQWAXWQN-HSZRJFAPSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50138627   
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
Palmitoyl-CoA oxidase


(Rattus norvegicus)
BDBM50138627
PNG
(2-{4-[(R)-2-Hydroxy-3-(2-methyl-benzothiazol-5-ylo...)
Show SMILES Cc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)Nc4cccc(Oc5ccccc5)c4)CC3)ccc2s1
Show InChI InChI=1S/C29H32N4O4S/c1-21-30-27-17-25(10-11-28(27)38-21)36-20-23(34)18-32-12-14-33(15-13-32)19-29(35)31-22-6-5-9-26(16-22)37-24-7-3-2-4-8-24/h2-11,16-17,23,34H,12-15,18-20H2,1H3,(H,31,35)/t23-/m1/s1
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MMDB

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n/an/a 360n/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