SCHEMBL8932133

SCHEMBL8932133

CC(CC(=O)C(N)c1ccccc1)C[C@H](N)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.51
GRM3 Q14832 2/20 0.51
KYNU Q16719 1/20 0.47
SLC1A2 P43004 4/20 0.44
SLC1A1 P43005 4/20 0.44
SLC1A3 P43003 3/20 0.44
GRIK1 P39086 2/20 0.43
ANPEP P15144 1/20 0.43
RNPEP Q9H4A4 1/20 0.43
DNPEP Q9ULA0 1/20 0.43
GRIK2 Q13002 1/20 0.43
SLC7A5 Q01650 2/20 0.43
ALPI P09923 1/20 0.42
PKM P14618 1/20 0.42
PTGS1 P23219 1/20 0.42
XIAP P98170 1/20 0.42
CYP2D6 P10635 1/20 0.40

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
SCHEMBL9341151 0.80 SLC7A5 (0.62) GRM2GRM3SLC1A2SLC1A1SLC1A3
SCHEMBL27170852 0.80 SLC7A5 (0.62) GRM2GRM3SLC1A2SLC1A1SLC1A3
SCHEMBL8530260 0.79 SLC1A1 (0.56) SLC1A2SLC1A1SLC1A3GRIK1ANPEP
SCHEMBL11148099 0.78 TSHR (0.53) GRM2GRM3SLC1A2SLC1A1SLC1A3
SCHEMBL28951586 0.76 SLC1A1 (0.50) GRM2GRM3SLC1A2SLC1A1SLC1A3
SCHEMBL18886173 0.76 GRM2 (0.61) GRM2GRM3KYNUSLC1A2SLC1A1
SCHEMBL5924823 0.76 GRM2 (0.61) GRM2GRM3KYNUSLC1A2SLC1A1
SCHEMBL5924700 0.76 GRM2 (0.61) GRM2GRM3KYNUSLC1A2SLC1A1
SCHEMBL6255681 0.76 GRM2 (0.61) GRM2GRM3KYNUSLC1A2SLC1A1
SCHEMBL5325189 0.76 GRM2 (0.61) GRM2GRM3KYNUSLC1A2SLC1A1

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-0775210-A1 MUTATED PENICILLIN G ACYLASE GENES GIST-BROCADES B.V. (NL) 1997-05-28 EP disclosed
WO-1996005318-A1 MUTATED PENICILLIN G ACYLASE GENES GIST-BROCADES B.V. (NL) 1996-02-22 WO disclosed