SCHEMBL4947418

SCHEMBL4947418

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nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.56
SLC1A1 P43005 5/20 0.52
SLC1A3 P43003 5/20 0.50
SLC1A2 P43004 5/20 0.50
PTGS1 P23219 1/20 0.48
SLC7A11 Q9UPY5 1/20 0.48
GRIK1 P39086 4/20 0.46
GRIK2 Q13002 4/20 0.46
GGT1 P19440 2/20 0.46
GRM1 Q13255 1/20 0.46
GRM2 Q14416 1/20 0.46
OR51E2 Q9H255 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
SCHEMBL393346 1.00 SLC7A5 (0.56) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
SCHEMBL4254400 1.00 SLC7A5 (0.56) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
SCHEMBL5819946 1.00 SLC7A5 (0.56) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
SCHEMBL5823952 1.00 SLC7A5 (0.56) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
SCHEMBL13746293 1.00 SLC7A5 (0.56) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
SCHEMBL196983 1.00 SLC7A5 (0.56) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
SCHEMBL1607862 1.00 SLC7A5 (0.56) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
SCHEMBL305904 1.00 SLC7A5 (0.56) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
SCHEMBL13753646 1.00 SLC7A5 (0.56) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1
SCHEMBL3744052 0.84 OR51E2 (0.42) SLC7A5SLC1A1SLC1A3SLC1A2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1578910-A4 NITRILASES VERENIUM CORP (US) 2008-06-04 EP disclosed
EP-1578910-A2 NITRILASES DIVERSA CORPORATION (US) 2005-09-28 EP disclosed
WO-2003000840-A2 NITRILASES DIVERSA CORPORATION (US) 2003-01-03 WO disclosed