DL-threo-β-hydroxyaspartate

Ligand id: 4497

Name: DL-threo-β-hydroxyaspartate

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 4
Rotatable bonds 3
Topological polar surface area 120.85
Molecular weight 149.03
XLogP -4.47
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

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Similar Ligands
L-homocysteine
Targets
Cystathionine β-synthase
L-cysteine
Targets
Alanine/serine/cysteine transporter 1; Alanine/serine/cysteine transporter 2; Cystathionine β-synthase; Cystathionine γ-lyase; Excitatory amino acid transporter 3; L-Cysteine:2-oxoglutarate aminotransferase; NTT4; sodium-coupled neutral amino acid transporter 1
D-cysteine
Targets
Proton-coupled Amino acid Transporter 1
2-amino-3-sulfinopropanoic acid
Targets
AGC1; AGC2
L-cysteine sulphinic acid
[3H]L-aspartic acid
Targets
Excitatory amino acid transporter 1; Excitatory amino acid transporter 2; Excitatory amino acid transporter 3; Excitatory amino acid transporter 4; Excitatory amino acid transporter 5
[3H]D-aspartic acid
Targets
Excitatory amino acid transporter 1; Excitatory amino acid transporter 2; Excitatory amino acid transporter 3; Excitatory amino acid transporter 4; Excitatory amino acid transporter 5
D-aspartic acid
Targets
Excitatory amino acid transporter 1; Excitatory amino acid transporter 2; Excitatory amino acid transporter 3; Excitatory amino acid transporter 4; Excitatory amino acid transporter 5; GluN1; GluN2A; GluN2B; GluN2C; GluN2D
L-aspartic acid
Targets
AGC2; Excitatory amino acid transporter 1; Excitatory amino acid transporter 3; Excitatory amino acid transporter 5; GluN2A; GluN2C; GluN2D; Glutamic acid decarboxylase 1; Glutamic acid decarboxylase 2; Sialin; mGlu2 receptor; mGlu5 receptor; mGlu6 receptor; mGlu7 receptor; mGlu8 receptor... click on ligand to see complete list
D-glutamic acid
Targets
Vesicular glutamate transporter 1; Vesicular glutamate transporter 2; Vesicular glutamate transporter 3
L-glutamic acid
Targets
GluA3; GluA4; GluD1; GluD2; GluK1; GluK2; GluN2A; GluN2C; GluN2D; GluN3A; mGlu2 receptor; mGlu5 receptor; mGlu6 receptor; mGlu7 receptor; mGlu8 receptor... click on ligand to see complete list
penicillamine
L-methionine
Targets
ATB0,+; Alanine/serine/cysteine transporter 2; B0AT1; B0AT2; B0AT3; L-type amino acid transporter 3; L-type amino acid transporter 4; NTT4; sodium-coupled neutral amino acid transporter 1; sodium-coupled neutral amino acid transporter 2
L-asparagine
Targets
Alanine/serine/cysteine transporter 2; B0AT1; B0AT2; Sodium-coupled neutral amino acid transporter 3; Sodium-coupled neutral amino acid transporter 5; sodium-coupled neutral amino acid transporter 1; sodium-coupled neutral amino acid transporter 2; sodium-coupled neutral amino acid transporter 4
D-ornithine
Targets
Mitochondrial ornithine transporter 2
L-ornithine
Targets
Cationic amino acid transporter 3; GPRC6 receptor; High affinity cationic amino acid transporter 1; Low affinity cationic amino acid transporter 2; Mitochondrial ornithine transporter 1 ; Mitochondrial ornithine transporter 2; Ornithine decarboxylase
[14C]glutamine
Targets
Sodium-coupled neutral amino acid transporter 3
[3H]glutamine
Targets
Sodium-coupled neutral amino acid transporter 3
L-glutamine
Targets
Alanine/serine/cysteine transporter 2; B0AT3; GPRC6 receptor; NTT4; Sodium-coupled neutral amino acid transporter 3; Sodium-coupled neutral amino acid transporter 5; sodium-coupled neutral amino acid transporter 1; sodium-coupled neutral amino acid transporter 2; sodium-coupled neutral amino acid transporter 4
L-threonine
Targets
Alanine/serine/cysteine transporter 1; Alanine/serine/cysteine transporter 2; B0AT1; B0AT2; sodium-coupled neutral amino acid transporter 1; sodium-coupled neutral amino acid transporter 2
D-lysine
Targets
Mitochondrial ornithine transporter 2
L-lysine
Targets
Cationic amino acid transporter 3; GPRC6 receptor; High affinity cationic amino acid transporter 1; Low affinity cationic amino acid transporter 2; Mitochondrial ornithine transporter 1 ; Mitochondrial ornithine transporter 2; sodium-coupled neutral amino acid transporter 4
D-serine
Targets
GluN1; GluN2A; GluN2B; GluN2C; GluN2D; Proton-coupled Amino acid Transporter 1
L-serine
Targets
ATB0,+; Alanine/serine/cysteine transporter 1; Alanine/serine/cysteine transporter 2; B0AT1; B0AT2; CaS receptor; GPRC6 receptor; NTT4; Sodium-coupled neutral amino acid transporter 5; sodium-coupled neutral amino acid transporter 1; sodium-coupled neutral amino acid transporter 2; sodium-coupled neutral amino acid transporter 4
[3H]alanine
Targets
sodium-coupled neutral amino acid transporter 1; sodium-coupled neutral amino acid transporter 2; sodium-coupled neutral amino acid transporter 4
[14C]alanine
Targets
sodium-coupled neutral amino acid transporter 1; sodium-coupled neutral amino acid transporter 2; sodium-coupled neutral amino acid transporter 4
L-alanine
Targets
Alanine/serine/cysteine transporter 1; Alanine/serine/cysteine transporter 2; B0AT1; B0AT2; B0AT3; CaS receptor; GPRC6 receptor; NTT4; Proton-coupled Amino acid Transporter 1; Proton-coupled Amino acid Transporter 2; Sodium-coupled neutral amino acid transporter 3; Sodium-coupled neutral amino acid transporter 5; sodium-coupled neutral amino acid transporter 1; sodium-coupled neutral amino acid transporter 2; sodium-coupled neutral amino acid transporter 4
D-alanine
Targets
Proton-coupled Amino acid Transporter 1
threo-3-methylglutamate
Targets
Excitatory amino acid transporter 2; Excitatory amino acid transporter 4
malic acid
Targets
Mitochondrial citrate transporter; Mitochondrial dicarboxylate transporter; Mitochondrial oxoglutarate carrier; TRPP2
s-allylglycine
Targets
Glutamic acid decarboxylase 1; Glutamic acid decarboxylase 2
β-Cyano-L-alanine
Targets
Cystathionine γ-lyase
NMDA
Targets
GluN1; GluN2A; GluN2B; GluN2C; GluN2D
L-leucine
Targets
ATB0,+; Alanine/serine/cysteine transporter 2; B0AT1; B0AT2; B0AT3; L-type amino acid transporter 3; L-type amino acid transporter 4; NTT4; sodium-coupled neutral amino acid transporter 2; sodium-coupled neutral amino acid transporter 4
L-isoleucine
Targets
ATB0,+; B0AT1; B0AT2; L-type amino acid transporter 3; L-type amino acid transporter 4