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BDBM50156430 (R)-1-{(S)-4-[5-(2,4-Dichloro-phenyl)-[1,2,4]oxadiazol-3-ylmethyl]-2-methyl-piperazin-1-yl}-3-(2-methyl-benzothiazol-5-yloxy)-propan-2-ol::CHEMBL185174

SMILES: C[C@H]1CN(Cc2noc(n2)-c2ccc(Cl)cc2Cl)CCN1C[C@@H](O)COc1ccc2sc(C)nc2c1

InChI Key: InChIKey=PLGJMSIIMZDAQM-MAUKXSAKSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50156430   
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)
BDBM50156430
PNG
((R)-1-{(S)-4-[5-(2,4-Dichloro-phenyl)-[1,2,4]oxadi...)
Show SMILES C[C@H]1CN(Cc2noc(n2)-c2ccc(Cl)cc2Cl)CCN1C[C@@H](O)COc1ccc2sc(C)nc2c1
Show InChI InChI=1S/C25H27Cl2N5O3S/c1-15-11-31(13-24-29-25(35-30-24)20-5-3-17(26)9-21(20)27)7-8-32(15)12-18(33)14-34-19-4-6-23-22(10-19)28-16(2)36-23/h3-6,9-10,15,18,33H,7-8,11-14H2,1-2H3/t15-,18+/m0/s1
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CHEMBL
PC cid
PC sid
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Similars

Article
PubMed
n/an/a 120n/an/an/an/an/an/a



CV Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibition of palmitoyl-CoA oxidation in rat heart mitochondria


Bioorg Med Chem Lett 14: 6017-21 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.077
BindingDB Entry DOI: 10.7270/Q2ZS2W0R
More data for this
Ligand-Target Pair
Palmitoyl-CoA oxidase


(Rattus norvegicus)
BDBM50156430
PNG
((R)-1-{(S)-4-[5-(2,4-Dichloro-phenyl)-[1,2,4]oxadi...)
Show SMILES C[C@H]1CN(Cc2noc(n2)-c2ccc(Cl)cc2Cl)CCN1C[C@@H](O)COc1ccc2sc(C)nc2c1
Show InChI InChI=1S/C25H27Cl2N5O3S/c1-15-11-31(13-24-29-25(35-30-24)20-5-3-17(26)9-21(20)27)7-8-32(15)12-18(33)14-34-19-4-6-23-22(10-19)28-16(2)36-23/h3-6,9-10,15,18,33H,7-8,11-14H2,1-2H3/t15-,18+/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 180n/an/an/an/an/an/a



CV Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibition of palmitoyl-CoA oxidation in rat heart mitochondria


Bioorg Med Chem Lett 14: 6017-21 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.077
BindingDB Entry DOI: 10.7270/Q2ZS2W0R
More data for this
Ligand-Target Pair