BindingDB logo
myBDB logout

BDBM50025837 (S)-2-Amino-3-{4-[bis-(2-chloro-ethyl)-amino]-phenyl}-propionic acid::(S)-2-amino-3-(4-(bis(2-chloroethyl)amino)phenyl)propanoic acid::2-Amino-3-{4-[bis-(2-chloro-ethyl)-amino]-phenyl}-propionic acid::2-Amino-3-{4-[bis-(2-chloro-ethyl)-amino]-phenyl}-propionic acid (melphalan)::2-Amino-3-{4-[bis-(2-chloro-ethyl)-amino]-phenyl}-propionic acid(L-PAM)::2-Amino-3-{4-[bis-(2-chloro-ethyl)-amino]-phenyl}-propionic acid(Melphalan)::2-amino-3-(4-(bis(2-chloroethyl)amino)phenyl)propanoic acid::2-amino-3-[4-bis(2-chloroethyl)amino]phenylpropanoic acid::3-(p-(bis(2-chloroethyl)amino)phenyl)-L-alanine::Alanine Nitrogen Mustard::Alkeran::CB-3025::CHEMBL852::L-Sarcolysin::MELPHALAN::Melfalan::Phenylalanine Mustard

SMILES: N[C@@H](Cc1ccc(cc1)N(CCCl)CCCl)C(O)=O

InChI Key: InChIKey=SGDBTWWWUNNDEQ-LBPRGKRZSA-N

Data: 1 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 1 hit for monomerid = 50025837   
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
L-type amino acid transporter 1


(Rattus norvegicus)
BDBM50025837
PNG
((S)-2-Amino-3-{4-[bis-(2-chloro-ethyl)-amino]-phen...)
Show SMILES N[C@@H](Cc1ccc(cc1)N(CCCl)CCCl)C(O)=O
Show InChI InChI=1S/C13H18Cl2N2O2/c14-5-7-17(8-6-15)11-3-1-10(2-4-11)9-12(16)13(18)19/h1-4,12H,5-9,16H2,(H,18,19)/t12-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
KEGG
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
5.50E+4n/an/an/an/an/an/an/an/a



University of Kentucky

Curated by ChEMBL


Assay Description
Inhibition of LAT1-mediated L-[14C]-leucine uptake in Sprague-Dawley rat brain by duel-labeled liquid scintillation counting


Bioorg Med Chem Lett 20: 3688-91 (2010)

More data for this
Ligand-Target Pair