Phenylalanine

Phenylalanine

SCHEMBL6130124

C[C@@H](OC(=O)[C@@H](N)CCCCN)[C@H](N)C(=O)O.N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.52

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 4/20 0.51
ALPI P09923 1/20 0.51
PKM P14618 1/20 0.51
PTGS1 P23219 1/20 0.51
XIAP P98170 1/20 0.51
MMP2 P08253 1/20 0.48
ITGB3 P05106 1/20 0.48
ITGA2B P08514 1/20 0.48
ANPEP P15144 2/20 0.43
GSR P00390 1/20 0.43
THRB P10828 1/20 0.43
RNPEP Q9H4A4 1/20 0.42
DNPEP Q9ULA0 1/20 0.42
LTA4H P09960 2/20 0.42
SLC1A3 P43003 2/20 0.42
SLC1A2 P43004 2/20 0.42
SLC1A1 P43005 2/20 0.42
ERAP2 Q6P179 1/20 0.40
LNPEP Q9UIQ6 1/20 0.40
MC4R P32245 1/20 0.39

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
SCHEMBL222259 0.93 MMP2 (0.46) SLC7A5ALPIPKMPTGS1XIAP
Tyrosine SCHEMBL11404581 0.87 SLC7A5 (0.49) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL4586624 0.85 ALPI (0.57) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL1162106 0.85 GSR (0.55) SLC7A5GSRRNPEP
Phenylalanine SCHEMBL6130121 0.84 SLC7A5 (0.61) SLC7A5ALPIPKMPTGS1XIAP
Phenylalanine SCHEMBL222260 0.83 SLC7A5 (0.56) SLC7A5ALPIPKMPTGS1XIAP
Phenylalanine SCHEMBL6130126 0.83 SLC7A5 (0.56) SLC7A5ALPIPKMPTGS1XIAP
Dl-Phenylalanine SCHEMBL22400727 0.83 SLC7A5 (0.56) SLC7A5ALPIPKMPTGS1XIAP
Phenylalanine SCHEMBL9216397 0.83 SLC7A5 (0.59) SLC7A5ALPIPKMPTGS1XIAP
Phenylalanine SCHEMBL1921946 0.82 SLC7A5 (0.63) SLC7A5ALPIPKMPTGS1XIAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1315752-A4 MODIFIED PROTEINS, ISOLATED NOVEL PEPTIDES, AND USES THEREOF UNIV AUSTRALIAN (AU) 2005-07-06 EP disclosed
US-20040091964-A1 Modified proteins, isolated novel peptides,and uses thereof BOARD PHILLIP (AU) 2004-05-13 US disclosed
EP-1315752-A1 MODIFIED PROTEINS, ISOLATED NOVEL PEPTIDES, AND USES THEREOF THE AUSTRALIAN NATIONAL UNIVERSITY (AU) 2003-06-04 EP disclosed
WO-2002018438-A9 MODIFIED PROTEINS, ISOLATED NOVEL PEPTIDES, AND USES THEREOF UNIV AUSTRALIAN (AU) 2002-05-30 WO disclosed
WO-2002018438-A1 MODIFIED PROTEINS, ISOLATED NOVEL PEPTIDES, AND USES THEREOF THE AUSTRALIAN NATIONAL UNIVERSITY (AU) 2002-03-07 WO disclosed