SCHEMBL28160789

SCHEMBL28160789

CC(=O)C(CC(N)C(=O)O)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SLC7A5 Q01650 1/20 0.58
▸ SLC1A2 P43004 7/20 0.52
▸ SLC1A1 P43005 7/20 0.52
▸ SLC1A3 P43003 6/20 0.52
▸ GRIK1 P39086 9/20 0.50
▸ GRIK2 Q13002 8/20 0.48
▸ PTGS1 P23219 1/20 0.44
▸ SLC7A11 Q9UPY5 1/20 0.44
▸ GRM1 Q13255 1/20 0.43
▸ GRM2 Q14416 1/20 0.43

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
SCHEMBL28160788 1.00 SLC7A5 (0.58) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
SCHEMBL39093 0.84 SLC7A5 (0.62) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
SCHEMBL4303994 0.84 SLC7A5 (0.62) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
SCHEMBL148584 0.84 SLC7A5 (0.62) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
SCHEMBL445471 0.84 SLC7A5 (0.62) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
SCHEMBL9698292 0.82 SLC7A5 (0.61) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
SCHEMBL9586717 0.81 RNPEP (0.38) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
Alanine SCHEMBL10991017 0.80 SLC7A5 (0.65) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
SCHEMBL13225821 0.78 ENPEP (0.40) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1
SCHEMBL29024969 0.78 SLC7A5 (0.68) SLC7A5SLC1A2SLC1A1SLC1A3GRIK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106970163-A A kind of aceglutamide metabolite identification detection method 浙江中医药大学 2017-07-21 — — CN disclosed
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