SCHEMBL9545322

SCHEMBL9545322

N[C@@H](C[C@H](N)C(=O)O)C(=O)O

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.68
SLC1A1 P43005 5/20 0.62
SLC1A3 P43003 5/20 0.59
SLC1A2 P43004 5/20 0.59
PTGS1 P23219 1/20 0.58
SLC7A11 Q9UPY5 1/20 0.58
GRIK1 P39086 5/20 0.55
GRIK2 Q13002 5/20 0.55
GGT1 P19440 4/20 0.55
GRM1 Q13255 2/20 0.55
GRM2 Q14416 2/20 0.55
GRM8 O00222 1/20 0.52
GRM6 O15303 1/20 0.52
GRIN2D O15399 1/20 0.52
GRIN3B O60391 1/20 0.52
GSR P00390 1/20 0.52
CYP1A2 P05177 1/20 0.52
GRM5 P41594 1/20 0.52
GRIA1 P42261 1/20 0.52
GRIA2 P42262 1/20 0.52

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
SCHEMBL29024969 1.00 SLC7A5 (0.68) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
SCHEMBL600881 1.00 SLC7A5 (0.68) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
Hydrochloric Acid SCHEMBL8892666 0.97 SLC7A5 (0.65) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
SCHEMBL39093 0.87 SLC7A5 (0.62) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
SCHEMBL6232483 0.87 SLC7A5 (0.62) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
SCHEMBL148584 0.87 SLC7A5 (0.62) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
SCHEMBL4303994 0.87 SLC7A5 (0.62) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
SCHEMBL445471 0.87 SLC7A5 (0.62) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
SCHEMBL9698292 0.86 SLC7A5 (0.61) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
SCHEMBL3175476 0.84

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
WO-1993024523-A1 DOUBLE CHAIN PEPTIDE COMPOUNDS HAVING HEMOREGULATORY ACTIVITY HAFSLUND NYCOMED AS (NO) 1993-12-09 WO disclosed