Asparagine

Asparagine

SCHEMBL7855644

C[C@H](N)C(=O)O.NC(=O)C[C@H](N)C(=O)O.O=C(O)[C@@H]1[C@H](c2ccc3ccccc3c2)CC[N+]12C(=O)CCC2=O

nearest known ligand 0.34

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Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.34
SLC1A2 P43004 1/20 0.34
SLC1A1 P43005 1/20 0.34
GRIK1 P39086 1/20 0.34
GRIK2 Q13002 1/20 0.34
GRIK3 Q13003 1/20 0.34
HCAR2 Q8TDS4 1/20 0.32
SLC6A4 P31645 2/20 0.32
SLC6A3 Q01959 2/20 0.32
TPH1 P17752 1/20 0.31

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
Asparagine SCHEMBL2927424 0.95 SLC1A3 (0.32) SLC1A3SLC1A2SLC1A1GRIK1GRIK2
Asparagine SCHEMBL2902140 0.83
Asparagine SCHEMBL2902050 0.73 SLC1A3 (0.34) SLC1A3SLC1A2SLC1A1TPH1
SCHEMBL2906893 0.72 CTSB (0.39)
Asparagine SCHEMBL7855451 0.69 MC4R (0.36) SLC6A4SLC6A3
Asparagine SCHEMBL28219869 0.64 SLC7A5 (0.52) SLC1A3SLC1A2SLC1A1GRIK1GRIK2
Dl-Phenylalanine SCHEMBL28019412 0.61 SLC7A5 (0.69) SLC1A3SLC1A2SLC1A1GRIK1GRIK2
Asparagine SCHEMBL7325420 0.61 SLC7A5 (0.56) SLC1A3SLC1A2SLC1A1GRIK1GRIK2
Asparagine SCHEMBL14486114 0.61 SLC7A5 (0.56) SLC1A3SLC1A2SLC1A1GRIK1GRIK2
Asparagine SCHEMBL14486115 0.61 SLC7A5 (0.56) SLC1A3SLC1A2SLC1A1GRIK1GRIK2

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
EP-1157040-A1 LOW MOLECULAR WEIGHT PEPTIDE DERIVATIVES AS INHIBITORS OF THE LAMININ/NIDOGEN INTERACTION Aventis Pharma Deutschland GmbH (DE) 2001-11-28 EP disclosed
WO-2000052051-A1 LOW MOLECULAR WEIGHT PEPTIDE DERIVATIVES AS INHIBITORS OF THE LAMININ/NIDOGEN INTERACTION AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2000-09-08 WO disclosed