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BDBM50138622 2-{4-[(R)-2-Hydroxy-3-(2-methyl-benzothiazol-5-yloxy)-propyl]-piperazin-1-yl}-N-(4-trifluoromethyl-phenyl)-acetamide::CHEMBL153666

SMILES: Cc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)Nc4ccc(cc4)C(F)(F)F)CC3)ccc2s1

InChI Key: InChIKey=BRRXOZCVEUETJG-LJQANCHMSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50138622   
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)		BDBM50138622
PNG
(2-{4-[(R)-2-Hydroxy-3-(2-methyl-benzothiazol-5-ylo...)
Show SMILES Cc1nc2cc(OC[C@H](O)CN3CCN(CC(=O)Nc4ccc(cc4)C(F)(F)F)CC3)ccc2s1
Show InChI InChI=1S/C24H27F3N4O3S/c1-16-28-21-12-20(6-7-22(21)35-16)34-15-19(32)13-30-8-10-31(11-9-30)14-23(33)29-18-4-2-17(3-5-18)24(25,26)27/h2-7,12,19,32H,8-11,13-15H2,1H3,(H,29,33)/t19-/m1/s1
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PubMed
n/an/a 7.60E+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)


BindingDB Entry DOI: 10.7270/Q2GH9HD4
More data for this
Ligand-Target Pair