Aspartic Acid

Aspartic Acid

SCHEMBL7700638

Cc1cc(=O)oc2cc(N)ccc12.NC(CC(=O)O)C(=O)O

nearest known ligand 0.66

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 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.66
KDM4E B2RXH2 7/20 0.66
HPGD P15428 5/20 0.66
GLA P06280 5/20 0.66
GAA P10253 5/20 0.66
CA9 Q16790 5/20 0.66
HSD17B10 Q99714 4/20 0.66
CA12 O43570 4/20 0.66
CA1 P00915 4/20 0.66
CASP1 P29466 2/20 0.66
CASP7 P55210 2/20 0.66
LMNA P02545 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
AKR1B1 P15121 1/20 0.48
UGT1A1 P22309 1/20 0.48
MAOB P27338 1/20 0.48
KDR P35968 1/20 0.48
HSD17B3 P37058 1/20 0.48

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 SCHEMBL7700642 1.00 ALDH1A1 (0.66) ALDH1A1KDM4EHPGDGLAGAA
Asparagine SCHEMBL27896279 0.92 ALDH1A1 (0.64) ALDH1A1KDM4EHPGDGLAGAA
Asparagine SCHEMBL4176738 0.92 ALDH1A1 (0.64) ALDH1A1KDM4EHPGDGLAGAA
Leucine SCHEMBL19695473 0.89 ALDH1A1 (0.64) ALDH1A1KDM4EHPGDGLAGAA
Leucine SCHEMBL27779804 0.89 ALDH1A1 (0.64) ALDH1A1KDM4EHPGDGLAGAA
Leucine SCHEMBL1776947 0.89 ALDH1A1 (0.64) ALDH1A1KDM4EHPGDGLAGAA
Serine SCHEMBL6428011 0.89 ALDH1A1 (0.68) ALDH1A1KDM4EHPGDGLAGAA
Serine SCHEMBL27896307 0.89 ALDH1A1 (0.68) ALDH1A1KDM4EHPGDGLAGAA
Leucine SCHEMBL4185791 0.88 ALDH1A1 (0.63) ALDH1A1KDM4EHPGDGLAGAA
Leucine SCHEMBL22611961 0.88 ALDH1A1 (0.63) ALDH1A1KDM4EHPGDGLAGAA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102994387-A High throughput screening method of aminopeptidase and high-yield strain thereof TIANJIN INST IND BIOTECHNOLOGY 2013-03-27 CN claimed
CN-105288619-A Non-invasive systems and methods for in-situ photobiomodulation UNIV DUKE 2016-02-03 CN disclosed
CN-102056625-B Non-invasive system and method for in situ photobiomodulation IMMUNOLIGHT, LLC (US) 2015-11-25 CN disclosed
CN-102994387-A High throughput screening method of aminopeptidase and high-yield strain thereof TIANJIN INST IND BIOTECHNOLOGY 2013-03-27 CN disclosed
US-6348570-B1 TETRAPEPTIDES; DIAGNOSING AND MONITORING INFLAMMATORY, NERVOUS SYSTEM, SKIN, CARDIOVASCULAR, RESPIRATORY SYSTEM, GASTROINTESTINAL, UROGENITAL AND IMMUNE DISORDERS; EVALUATING INHIBITORS MERCK & CO., INC. 2002-02-19 US disclosed