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Sugi Predict / Compounds / Aspartic Acid

Aspartic Acid

Aspartic Acid

SCHEMBL27469897

CCN.NC(CC(=O)O)C(=O)O

nearest known ligand 0.52

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
▸ SLC7A5 Q01650 1/20 0.52
▸ SLC1A3 P43003 6/20 0.52
▸ SLC1A2 P43004 6/20 0.52
▸ SLC1A1 P43005 5/20 0.52
▸ GRIK1 P39086 11/20 0.52
▸ GRIA4 P48058 4/20 0.52
▸ GRIK3 Q13003 4/20 0.52
▸ GRIK5 Q16478 4/20 0.52
▸ GRIK2 Q13002 7/20 0.50
▸ GRM1 Q13255 2/20 0.48
▸ GRM2 Q14416 2/20 0.48
▸ GRIA2 P42262 3/20 0.46
▸ GRIA1 P42261 2/20 0.46
▸ GRM8 O00222 1/20 0.46
▸ GRM6 O15303 1/20 0.46
▸ GRIN2D O15399 1/20 0.46
▸ GRIN3B O60391 1/20 0.46
▸ GSR P00390 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ GRM5 P41594 1/20 0.46

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 SCHEMBL11269603 0.90 GRIK1 (0.54) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Aspartic Acid SCHEMBL135731 0.90 GRIK1 (0.57) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Aspartic Acid SCHEMBL28302585 0.90 SLC7A5 (0.52) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Aspartic Acid SCHEMBL7781258 0.90 GRIK1 (0.57) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Aspartic Acid SCHEMBL7782858 0.90 GRIK1 (0.54) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Aspartic Acid SCHEMBL7781260 0.90 GRIK1 (0.57) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Aspartic Acid SCHEMBL8383423 0.90 SLC7A5 (0.56) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Aspartic Acid SCHEMBL7204816 0.90 SLC7A5 (0.56) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Aspartic Acid SCHEMBL28054217 0.90 SLC7A5 (0.56) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
Aspartic Acid SCHEMBL7204819 0.90 SLC7A5 (0.56) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1315780-C Process for producing n-(1-(2,4-dichlorophenyl)ethyl)-2- cyano-3,3-dimethylbutanamide SUMITOMO CHEMICAL CO (JP) 2007-05-16 — — CN disclosed
CN-1243720-C Process for producing n-(1-(2,4-dichlorophenyl)ethyl)-2- cyano-3,3-dimethylbutanamide SUMITOMO CHEMICAL CO (JP) 2006-03-01 — — CN disclosed
CN-1243719-C Process for producing N- [1- (2, 4-dichlorophenyl) ethyl ] -2-cyano-3, 3-dimethylbutanamide SUMITOMO CHEMICAL CO (JP) 2006-03-01 — — CN disclosed
CN-1680273-A Process for producing n-(1-(2,4-dichlorophenyl)ethyl)-2- cyano-3,3-dimethylbutanamide SUMITOMO CHEMICAL CO (JP) 2005-10-12 — — CN disclosed
CN-1526696-A Process for producing N- [ 1- (2, 4-dichlorophenyl) ethyl ] -2-cyano-3, 3-dimethylbutanamide 住友化学工业株式会社 2004-09-08 — — CN disclosed
CN-1524845-A Process for producing n-(1-(2,4-dichlorophenyl)ethyl)-2- cyano-3,3-dimethylbutanamide 住友化学工业株式会社 2004-09-01 — — CN disclosed
CN-1153762-C Process for producing N- [1- (2, 4-dichlorophenyl) ethyl ] -2-cyano-3, 3-dimethylbutanamide 住友化学工业株式会社 2004-06-16 — — CN disclosed
CN-1131146-A Process for producing N- [1- (2, 4-dichlorophenyl) ethyl ] -2-cyano-3, 3-dimethylbutanamide SUMITOMO CHEMICAL CO (JP) 1996-09-18 — — CN disclosed