Aspartic Acid

Aspartic Acid

SCHEMBL8449756

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

nearest known ligand 0.42

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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 17)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.39
GRIK1 P39086 8/20 0.39
GRIK2 Q13002 5/20 0.39
NOS2 P35228 2/20 0.38
SLC1A3 P43003 5/20 0.38
SLC1A2 P43004 5/20 0.38
SLC1A1 P43005 5/20 0.38
GRM1 Q13255 1/20 0.37
GRM2 Q14416 1/20 0.37
GRIA4 P48058 3/20 0.37
GRIK3 Q13003 3/20 0.37
GRIK5 Q16478 3/20 0.37
BHMT Q93088 1/20 0.37
NOS3 P29474 1/20 0.37
NOS1 P29475 1/20 0.37
GRIA2 P42262 2/20 0.36
GRIA1 P42261 1/20 0.36

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
SCHEMBL8728286 0.89 SLC22A6 (0.35) NOS2
Aspartic Acid SCHEMBL28054217 0.76 SLC7A5 (0.56) SLC7A5GRIK1GRIK2SLC1A3SLC1A2
Aspartic Acid SCHEMBL7204819 0.76 SLC7A5 (0.56) SLC7A5GRIK1GRIK2SLC1A3SLC1A2
Aspartic Acid SCHEMBL2281229 0.76 GRIK1 (0.52) SLC7A5GRIK1GRIK2SLC1A3SLC1A2
Aspartic Acid SCHEMBL7204816 0.76 SLC7A5 (0.56) SLC7A5GRIK1GRIK2SLC1A3SLC1A2
Aspartic Acid SCHEMBL2281231 0.76 GRIK1 (0.52) SLC7A5GRIK1GRIK2SLC1A3SLC1A2
Aspartic Acid SCHEMBL8383423 0.76 SLC7A5 (0.56) SLC7A5GRIK1GRIK2SLC1A3SLC1A2
Aspartic Acid SCHEMBL8159324 0.76 GRIK1 (0.52) SLC7A5GRIK1GRIK2SLC1A3SLC1A2
Aspartic Acid SCHEMBL8159323 0.76 GRIK1 (0.52) SLC7A5GRIK1GRIK2SLC1A3SLC1A2
Aspartic Acid SCHEMBL1526976 0.76 GRIK1 (0.56) SLC7A5GRIK1GRIK2SLC1A3SLC1A2

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-5876623-A ANTIDEPOSIT AGENT NALCO CHEMICAL COMPANY (US) 1999-03-02 US disclosed
EP-0831066-A1 Biodegradable Aspartic acid polymers for preventing scale formation in boilers NALCO CHEMICAL COMPANY (US) 1998-03-25 EP disclosed