Dl-Phenylalanine

Dl-Phenylalanine

SCHEMBL9318540

C1CCC(NC2CCCCC2)CC1.NC(Cc1ccccc1)C(=O)O.NC(Cc1ccccc1)C(=O)O

nearest known ligand 0.65

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.65
ALPI P09923 1/20 0.65
PKM P14618 1/20 0.65
PTGS1 P23219 1/20 0.65
XIAP P98170 1/20 0.65
ANPEP P15144 2/20 0.52
ERAP2 Q6P179 2/20 0.52
EPHX2 P34913 3/20 0.51
TDP1 Q9NUW8 1/20 0.50
SLC1A3 P43003 1/20 0.49
SLC1A2 P43004 1/20 0.49
SLC1A1 P43005 1/20 0.49
HPGD P15428 2/20 0.48
EPHX1 P07099 2/20 0.48
TAAR1 Q96RJ0 1/20 0.48
TPH1 P17752 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
DPP4 P27487 1/20 0.46
FAP Q12884 1/20 0.46
DPP8 Q6V1X1 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
Phenylalanine SCHEMBL9318542 1.00 SLC7A5 (0.65) SLC7A5ALPIPKMPTGS1XIAP
Dl-Phenylalanine SCHEMBL25221060 0.86 SLC7A5 (0.88) SLC7A5ALPIPKMPTGS1XIAP
Phenylalanine SCHEMBL8081643 0.85 SLC7A5 (0.56) SLC7A5ALPIPKMPTGS1XIAP
Dl-Phenylalanine SCHEMBL27841330 0.85 SLC7A5 (0.69) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL7383653 0.83 ALDH1A1 (0.46) SLC7A5ALPIPKMPTGS1XIAP
Phenylalanine SCHEMBL1392883 0.82 SLC7A5 (0.65) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL5766448 0.82 EPHX2 (0.51) ANPEPERAP2EPHX2TDP1HPGD
SCHEMBL6164081 0.82 TDP1 (0.64) SLC7A5ALPIPKMPTGS1XIAP
SCHEMBL353959 0.82 TDP1 (0.64) SLC7A5ALPIPKMPTGS1XIAP
Phenylalanine SCHEMBL11500321 0.82 SLC7A5 (0.69) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0593557-A1 AROMATIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE IN THERAPY. MERCK SHARP & DOHME (GB) 1994-04-27 EP disclosed
WO-1993001160-A1 AROMATIC COMPOUNDS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE IN THERAPY MERCK SHARP & DOHME LIMITED (GB) 1993-01-21 WO disclosed