Aspartic Acid

Aspartic Acid

SCHEMBL29223446

CNC(Cc1ccccc1)C(=O)O.NC(CC(=O)O)C(=O)O

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SLC6A2SLC6A3

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 18)

geneUniProtsupporting neighboursconfidence
ALPI P09923 1/20 0.56
PKM P14618 1/20 0.56
PTGS1 P23219 1/20 0.56
XIAP P98170 1/20 0.56
SLC7A5 Q01650 1/20 0.56
SLC1A3 P43003 2/20 0.53
SLC1A2 P43004 2/20 0.53
SLC1A1 P43005 2/20 0.53
CPA1 P15085 2/20 0.49
CPB1 P15086 1/20 0.49
CPA3 P15088 1/20 0.49
CPB2 Q96IY4 1/20 0.49
LTA4H P09960 3/20 0.48
MME P08473 2/20 0.47
NAALAD2 Q9Y3Q0 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
SLC15A1 P46059 1/20 0.45
ACE P12821 1/20 0.45

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
Phenylalanine SCHEMBL9186759 0.89 SLC7A5 (0.71) ALPIPKMPTGS1XIAPSLC7A5
Leucine SCHEMBL8740479 0.87 LTA4H (0.60) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL161255 0.86 MME (0.57) MMENAALAD2L3MBTL1
SCHEMBL7937827 0.86 MME (0.57) MMENAALAD2L3MBTL1
SCHEMBL38480 0.86 MME (0.57) MMENAALAD2L3MBTL1
SCHEMBL38479 0.86 MME (0.57) MMENAALAD2L3MBTL1
Methamphetamine SCHEMBL6462456 0.85 TAAR1 (0.62) ALPIPKMPTGS1XIAPSLC7A5
Methamphetamine SCHEMBL6462454 0.85 TAAR1 (0.62) ALPIPKMPTGS1XIAPSLC7A5
Alanine SCHEMBL8347469 0.84 ALPI (0.53) ALPIPKMPTGS1XIAPSLC7A5
Alanine SCHEMBL8347467 0.84 ALPI (0.53) ALPIPKMPTGS1XIAPSLC7A5

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
CN-117918557-A Emulsion, preparation method thereof, filter stick, tobacco product and application 福建中烟工业有限责任公司 2024-04-26 CN disclosed