Phenylalanine

Phenylalanine

SCHEMBL11240666

N[C@@H](Cc1ccccc1)C(=O)O.O=S(=O)(O)O.[NaH]

nearest known ligand 0.81

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Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Phenylalanine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 3/20 0.81
ALPI P09923 1/20 0.81
PKM P14618 1/20 0.81
PTGS1 P23219 1/20 0.81
XIAP P98170 1/20 0.81
SLC1A3 P43003 2/20 0.59
SLC1A2 P43004 2/20 0.59
SLC1A1 P43005 2/20 0.59
SLC15A1 P46059 1/20 0.54
CYP1A2 P05177 1/20 0.52
LTA4H P09960 1/20 0.51
GRIA2 P42262 1/20 0.51
TPH1 P17752 1/20 0.50
GRB2 P62993 1/20 0.50
NOS3 P29474 1/20 0.50
NOS1 P29475 1/20 0.50
NOS2 P35228 1/20 0.50

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
Phenylalanine SCHEMBL246543 0.98 SLC7A5 (0.85) SLC7A5ALPIPKMPTGS1XIAP
Dl-Phenylalanine SCHEMBL27873303 0.98 SLC7A5 (0.85) SLC7A5ALPIPKMPTGS1XIAP
Dl-Phenylalanine SCHEMBL246542 0.98 SLC7A5 (0.85) SLC7A5ALPIPKMPTGS1XIAP
Phenylalanine SCHEMBL2584996 0.92 SLC7A5 (0.96) SLC7A5ALPIPKMPTGS1XIAP
Phenylalanine SCHEMBL7226502 0.92 SLC7A5 (0.96) SLC7A5ALPIPKMPTGS1XIAP
Dl-Phenylalanine SCHEMBL28899613 0.92 SLC7A5 (0.96) SLC7A5ALPIPKMPTGS1XIAP
D-Phenylalanine SCHEMBL22656002 0.92 SLC7A5 (0.96) SLC7A5ALPIPKMPTGS1XIAP
Dl-Phenylalanine SCHEMBL6005348 0.92 SLC7A5 (0.96) SLC7A5ALPIPKMPTGS1XIAP
Phenylalanine SCHEMBL8610376 0.91 SLC7A5 (0.79) SLC7A5ALPIPKMPTGS1XIAP
Dl-Phenylalanine SCHEMBL8610372 0.91 SLC7A5 (0.79) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4314991-A POLYPHENYLALANINE OR POLYTYROSINE JOHNSON & JOHNSON PRODUCTS INC. (US) 1982-02-09 US disclosed