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BDBM50122828 CHEMBL106274::[3-Carboxy-2-(3-undecyl-ureido)-propyl]-trimethyl-ammonium

SMILES: CCCCCCCCCCCNC(=O)N[C@H](CC([O-])=O)C[N+](C)(C)C

InChI Key: InChIKey=LBXITKQZOZNVQI-QGZVFWFLSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50122828   
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
Carnitine palmitoyltransferase 1A


(Rattus norvegicus)
BDBM50122828
PNG
(CHEMBL106274 | [3-Carboxy-2-(3-undecyl-ureido)-pro...)
Show SMILES CCCCCCCCCCCNC(=O)N[C@H](CC([O-])=O)C[N+](C)(C)C
Show InChI InChI=1S/C19H39N3O3/c1-5-6-7-8-9-10-11-12-13-14-20-19(25)21-17(15-18(23)24)16-22(2,3)4/h17H,5-16H2,1-4H3,(H2-,20,21,23,24,25)/t17-/m1/s1
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KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.20E+3n/an/an/an/an/an/a



Sigma Tau Pharmaceutical Industries S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of [14C]-palmitoyl-CoA and carnitine binding to carnitine palmitoyltransferase I from rat liver mitochondria


J Med Chem 46: 303-9 (2003)


Article DOI: 10.1021/jm020979u
More data for this
Ligand-Target Pair
Carnitine palmitoyltransferase 1B


(Rattus norvegicus)
BDBM50122828
PNG
(CHEMBL106274 | [3-Carboxy-2-(3-undecyl-ureido)-pro...)
Show SMILES CCCCCCCCCCCNC(=O)N[C@H](CC([O-])=O)C[N+](C)(C)C
Show InChI InChI=1S/C19H39N3O3/c1-5-6-7-8-9-10-11-12-13-14-20-19(25)21-17(15-18(23)24)16-22(2,3)4/h17H,5-16H2,1-4H3,(H2-,20,21,23,24,25)/t17-/m1/s1
Reactome pathway

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.18E+5n/an/an/an/an/an/a



Sigma Tau Pharmaceutical Industries S.p.A.

Curated by ChEMBL


Assay Description
In vitro inhibition of [14C]-palmitoyl-CoA and carnitine binding to carnitine palmitoyltransferase I of rat heart mitochondria


J Med Chem 46: 303-9 (2003)


Article DOI: 10.1021/jm020979u
More data for this
Ligand-Target Pair