BindingDB logo
myBDB logout

BDBM50028807 1-Amino-3,4-dimethyl-hexan-2-ol::CHEMBL18828

SMILES: CCC(C)C(C)C(O)CN

InChI Key: InChIKey=ZGBXENYCJBQTCS-UHFFFAOYSA-N

Data: 1 IC50

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 1 hit for monomerid = 50028807   
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
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50028807
PNG
(1-Amino-3,4-dimethyl-hexan-2-ol | CHEMBL18828)
Show SMILES CCC(C)C(C)C(O)CN
Show InChI InChI=1S/C8H19NO/c1-4-6(2)7(3)8(10)5-9/h6-8,10H,4-5,9H2,1-3H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 4.03E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibitory activity against phenylethanolamine N-methyltransferase


J Med Chem 24: 7-12 (1981)


BindingDB Entry DOI: 10.7270/Q2PK0F59
More data for this
Ligand-Target Pair