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BDBM50000099 (2S)-2-aminopropanoic acid::(S)-2-aminopropanoic acid::(S)-alanine::Ala::CHEMBL279597::L-Alanin::L-alanine::L-alpha-alanine::US11021454, Compound L-ala

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

InChI Key: InChIKey=QNAYBMKLOCPYGJ-REOHCLBHSA-N

Data: 1 KI  2 IC50

PDB links: 79 PDB IDs match this monomer.

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50000099   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Proton-coupled amino acid transporter 1


(Homo sapiens (Human))
BDBM50000099
PNG
((2S)-2-aminopropanoic acid | (S)-2-aminopropanoic ...)
Show SMILES C[C@H](N)C(O)=O
Show InChI InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1
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DrugBank
Article
PubMed
2.80E+6n/an/an/an/an/an/an/an/a



Martin-Luther-University Halle-Wittenberg

Curated by ChEMBL


Assay Description
Inhibition of human PAT1-mediated L-[3H]proline uptake in human Caco2 cells after 10 mins by liquid scintillation counting


Bioorg Med Chem 19: 6409-18 (2011)

Checked by Author
Article DOI: 10.1016/j.bmc.2011.08.058
BindingDB Entry DOI: 10.7270/Q2NZ882D
More data for this
Ligand-Target Pair
Xanthine dehydrogenase


(Homo sapiens (Human))
BDBM50000099
PNG
((2S)-2-aminopropanoic acid | (S)-2-aminopropanoic ...)
Show SMILES C[C@H](N)C(O)=O
Show InChI InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1
PDB
MMDB

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US Patent
n/an/a>6.00E+4n/an/an/an/an/an/a



CHINA PHARMACEUTICAL UNIVERSITY

US Patent


Assay Description
11.1 Preparation of Reagents and Standard Solutions(1) 75 mM phosphate buffer (PB, pH 7.4): containing KH2PO4 0.0956 g, K2HPO4 0.6946 g, EDTA 1.862 m...


US Patent US11021454 (2021)

More data for this
Ligand-Target Pair
Glutamate receptor ionotropic, NMDA 1


(RAT)
BDBM50000099
PNG
((2S)-2-aminopropanoic acid | (S)-2-aminopropanoic ...)
Show SMILES C[C@H](N)C(O)=O
Show InChI InChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1
PDB

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Article
PubMed
n/an/a 1.98E+5n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibitory concentration of the compound required to inhibit [3H]-strychnine binding to N-methyl-D-aspartate glutamate receptor 1


J Med Chem 35: 233-41 (1992)


Article DOI: 10.1021/jm00080a006
BindingDB Entry DOI: 10.7270/Q26W9911
More data for this
Ligand-Target Pair