Phenylalanine Methyl Ester

Phenylalanine Methyl Ester

SCHEMBL9218451

CC(=O)N[C@@H](CC(C)C)C(=O)O.COC(=O)[C@@H](N)Cc1ccccc1

nearest known ligand 0.67

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Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 1/20 0.67
▸ MME P08473 2/20 0.56
▸ ALDH1A1 P00352 1/20 0.55
▸ ANPEP P15144 1/20 0.54
▸ BIRC2 Q13490 1/20 0.51

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 SCHEMBL9218447 0.90 LTA4H (0.60) LTA4HALDH1A1ANPEPBIRC2
Afalanine SCHEMBL11799100 0.90 GNPAT (0.55) LTA4HALDH1A1
Phenylalanine Methyl Ester SCHEMBL6748761 0.85 SLC7A5 (0.58) LTA4HANPEP
Phenylalanine Methyl Ester SCHEMBL15323534 0.84 SLC7A5 (0.61) LTA4HANPEP
SCHEMBL1396480 0.83 LTA4H (0.76) LTA4HMME
SCHEMBL29780321 0.83 LTA4H (0.76) LTA4HMME
SCHEMBL19707913 0.83 LTA4H (0.76) LTA4HMME
SCHEMBL1396477 0.83 LTA4H (0.76) LTA4HMME
SCHEMBL10443978 0.83 LTA4H (0.76) LTA4HMME
Phenylalanine Methyl Ester SCHEMBL6751576 0.82 SLC7A5 (0.61) LTA4HALDH1A1ANPEP

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-5395824-A Dipeptide derivative and prophylactic and therapeutic agent for bone diseases containing the same SUNTORY LIMITED (JP) 1995-03-07 — — US disclosed
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