Aspartic Acid

Aspartic Acid

SCHEMBL14742425

C[N+](C)(C)CCO.N[C@@H](CC(=O)O)C(=O)O

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SSTR1SSTR2SSTR3SSTR5

The experimentally established mechanism targets of Aspartic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
KMT2A Q03164 1/20 0.44
CYP3A4 P08684 1/20 0.44
SLC5A7 Q9GZV3 1/20 0.44
SLC7A5 Q01650 1/20 0.42
GRIK1 P39086 8/20 0.41
GRIK2 Q13002 5/20 0.41
SLC1A1 P43005 4/20 0.39
GRM1 Q13255 2/20 0.39
GRM2 Q14416 2/20 0.39
MAPT P10636 1/20 0.39
GRIA4 P48058 4/20 0.39
GRIK3 Q13003 4/20 0.39
GRIK5 Q16478 4/20 0.39
BHMT Q93088 1/20 0.39
SLC1A3 P43003 3/20 0.38
SLC1A2 P43004 3/20 0.38
GRIA2 P42262 3/20 0.38
GRIA1 P42261 2/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Aspartic Acid SCHEMBL14742424 1.00 MEN1 (0.44) MEN1LMNAKMT2ACYP3A4SLC5A7
Asparagine SCHEMBL28252681 0.87 KMT2A (0.43) MEN1LMNAKMT2ACYP3A4SLC5A7
Aspartic Acid SCHEMBL6033509 0.85 LMNA (0.41) MEN1LMNAKMT2ACYP3A4SLC5A7
Choline SCHEMBL1683101 0.84 KMT2A (0.48) MEN1LMNAKMT2ACYP3A4SLC5A7
Choline SCHEMBL1683106 0.84 KMT2A (0.48) MEN1LMNAKMT2ACYP3A4SLC5A7
Leucine SCHEMBL28252682 0.83 SLC7A5 (0.67) MEN1LMNAKMT2ACYP3A4SLC5A7
Glutamic Acid SCHEMBL10623303 0.81 GRM8 (0.64) MEN1LMNAKMT2ACYP3A4SLC5A7
D-Glutamate SCHEMBL10623300 0.81 GRM8 (0.64) MEN1LMNAKMT2ACYP3A4SLC5A7
Choline SCHEMBL22345960 0.81 LMNA (0.55) MEN1LMNAKMT2ACYP3A4SLC5A7
Aspartic Acid SCHEMBL14742381 0.81 GRIK1 (0.50) SLC7A5GRIK1GRIK2SLC1A1GRM1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013033046-A2 FLUORESCENT PL MARKERS FOR ISOELECTRIC FOCUSING SEPARATIONS AND FLUORESCENT LABELING VIGH GYULA (US) 2013-03-07 WO disclosed