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BDBM50037260 3-Amino-5,5-dimethyl-hexanoic acid anion

SMILES: CC(C)(C)CC(N)CC([O-])=O

InChI Key: InChIKey=ZBCPPTZVOXHDMT-UHFFFAOYSA-M

Data: 2 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50037260   
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 acetylase


(Homo sapiens (Human))
BDBM50037260
PNG
(3-Amino-5,5-dimethyl-hexanoic acid anion)
Show SMILES CC(C)(C)CC(N)CC([O-])=O
Show InChI InChI=1S/C8H17NO2/c1-8(2,3)5-6(9)4-7(10)11/h6H,4-5,9H2,1-3H3,(H,10,11)/p-1
PDB
MMDB

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PC cid
PC sid
UniChem
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2.60E+6n/an/an/an/an/an/an/an/a



University of Alabama at Birmingham

Curated by ChEMBL


Assay Description
Tested against pigeon breast carnitine acyltransferase


J Med Chem 37: 3247-51 (1994)


BindingDB Entry DOI: 10.7270/Q2VM4CXR
More data for this
Ligand-Target Pair
Carnitine palmitoyltransferase 2


(Rattus norvegicus)
BDBM50037260
PNG
(3-Amino-5,5-dimethyl-hexanoic acid anion)
Show SMILES CC(C)(C)CC(N)CC([O-])=O
Show InChI InChI=1S/C8H17NO2/c1-8(2,3)5-6(9)4-7(10)11/h6H,4-5,9H2,1-3H3,(H,10,11)/p-1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
PubMed
2.00E+7n/an/an/an/an/an/an/an/a



University of Alabama at Birmingham

Curated by ChEMBL


Assay Description
Tested against neonatal rat cardiac myocyte carnitine palmitoyltransferase 2


J Med Chem 37: 3247-51 (1994)


BindingDB Entry DOI: 10.7270/Q2VM4CXR
More data for this
Ligand-Target Pair