Phenylalanine

Phenylalanine

SCHEMBL4612880

CC(C)C[C@H](N)C(=O)OC[C@H](N)C(=O)O.CSCC[C@H](N)C(=O)OC(=O)[C@H](C)N.NC(=O)CC[C@H](N)C(=O)O.N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.39

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Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALPI P09923 1/20 0.38
PKM P14618 1/20 0.38
PTGS1 P23219 1/20 0.38
XIAP P98170 1/20 0.38
SLC7A5 Q01650 1/20 0.38
ANPEP P15144 1/20 0.37
RNPEP Q9H4A4 1/20 0.37
DNPEP Q9ULA0 1/20 0.37
IDO1 P14902 1/20 0.36
LTA4H P09960 1/20 0.36
KMT2A Q03164 1/20 0.35
FNTA P49354 3/20 0.34
FNTB P49356 3/20 0.34
PGGT1B P53609 1/20 0.34
KRAS P01116 1/20 0.34

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 SCHEMBL4612039 0.94 ALPI (0.39) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL14658220 0.87 ALPI (0.45) ALPIPKMPTGS1XIAPSLC7A5
Glutamine SCHEMBL2502331 0.84 THRB (0.36) ANPEPRNPEPDNPEP
Phenylalanine SCHEMBL6707277 0.80 THRB (0.34) ALPIPKMPTGS1XIAPSLC7A5
Phenylalanine SCHEMBL907512 0.79 SLC7A5 (0.58) ALPIPKMPTGS1XIAPSLC7A5
D-Phenylalanine SCHEMBL6450960 0.79 SLC7A5 (0.58) ALPIPKMPTGS1XIAPSLC7A5
Phenylalanine SCHEMBL8975267 0.79 SLC7A5 (0.61) ALPIPKMPTGS1XIAPSLC7A5
Arginine SCHEMBL16797281 0.78 NPY4R (0.36) ANPEPRNPEPDNPEPKMT2AFNTA
Methionine SCHEMBL6839644 0.76 ALPI (0.48) ALPIPKMPTGS1XIAPSLC7A5
SCHEMBL464778 0.76 ALPI (0.50) ALPIPKMPTGS1XIAPSLC7A5

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
EP-1498476-B1 MUTATED ALKALINE CELLULASE KAO CORP (JP) 2008-10-15 EP claimed