Aspartic Acid

Aspartic Acid

SCHEMBL7700994

NC(CC(=O)[O-])C(=O)[O-].[H+].[Li+]

nearest known ligand 0.46

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Known targets — ChEMBL curated mechanism

SLC6A2SLC6A3SSTR1SSTR2SSTR3SSTR5

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 11)

geneUniProtsupporting neighboursconfidence
CA4 P22748 4/20 0.46
CTSL P07711 1/20 0.42
CPT2 P23786 1/20 0.41
CPT1A P50416 1/20 0.41
CA2 P00918 1/20 0.40
SLC22A16 Q86VW1 1/20 0.34
GRIK1 P39086 1/20 0.30
GRIK2 Q13002 1/20 0.30
GRM1 Q13255 1/20 0.30
GRM2 Q14416 1/20 0.30
GSR P00390 1/20 0.30

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 SCHEMBL1459004 0.97
Aspartic Acid SCHEMBL2560053 0.97
Aspartic Acid SCHEMBL161238 0.97 CA4 (0.48) CA4CTSLCPT2CPT1ACA2
Aspartic Acid SCHEMBL161240 0.97 CA4 (0.48) CA4CTSLCPT2CPT1ACA2
Aspartic Acid SCHEMBL1303171 0.95 CA4 (0.46) CA4CTSLCPT2CPT1ACA2
Aspartic Acid SCHEMBL30939427 0.95 CA4 (0.46) CA4CTSLCPT2CPT1ACA2
Aspartic Acid SCHEMBL1300891 0.95 CA4 (0.46) CA4CTSLCPT2CPT1ACA2
Aspartic Acid SCHEMBL1301888 0.95 CA4 (0.46) CA4CTSLCPT2CPT1ACA2
Aspartic Acid SCHEMBL1302392 0.95 CA4 (0.46) CA4CTSLCPT2CPT1ACA2
Aspartic Acid SCHEMBL1301522 0.95 CA4 (0.46) CA4CTSLCPT2CPT1ACA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6355771-B1 MODIFIED BY MERCAPTOALKYLAMINE; CORROSION RESISTANCE, ANTISCALING AGENTS NIPPON SHOKUBAI CO., LTD. (JP) 2002-03-12 US disclosed
EP-0980883-A1 Modified polyaspartic acid, method for production thereof and use therefor Nippon Shokubai Co., Ltd. (JP) 2000-02-23 EP disclosed