Phenylalanine

Phenylalanine

SCHEMBL9010810

CC(C)C[C@H](N)C(=O)O[C@H](C)[C@H](N)C(=O)O.CC(C)[C@H](N)C(=O)O.CC[C@H](C)[C@H](N)C(=O)OC(=O)[C@@H](N)Cc1c[nH]c2ccccc12.CSCC[C@H](N)C(=O)O.NCCCC[C@H](N)C(=O)O.N[C@@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PPARDPTGS1PTGS2dacAdacBdacCftsImrcAmrcBmrdA

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 19)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 8/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
MPO P05164 1/20 0.39
MAPT P10636 1/20 0.39
TSHR P16473 1/20 0.39
BLM P54132 1/20 0.39
PMP22 Q01453 1/20 0.39
KMT2A Q03164 1/20 0.39
HIF1A Q16665 1/20 0.39
TLR2 O60603 4/20 0.38
MC4R P32245 2/20 0.38
CTSC P53634 1/20 0.38
MC5R P33032 1/20 0.38
MC3R P41968 1/20 0.38
ERAP2 Q6P179 1/20 0.36
ERAP1 Q9NZ08 1/20 0.36
LNPEP Q9UIQ6 1/20 0.36

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
Dl-Tryptophan SCHEMBL27444819 0.89 MEN1 (0.46) GHSRKDM4EMEN1LMNAMPO
Dl-Tryptophan SCHEMBL27369426 0.87 MEN1 (0.43) GHSRKDM4EMEN1LMNAMPO
Tryptophan SCHEMBL9010812 0.87 MEN1 (0.43) GHSRKDM4EMEN1LMNAMPO
Lysine SCHEMBL9280396 0.85 MEN1 (0.45) GHSRKDM4EMEN1LMNAMPO
SCHEMBL2638017 0.84 KDM4E (0.48) GHSRKDM4EMEN1LMNAMPO
Phenylalanine SCHEMBL6437301 0.83 GHSR (0.39) GHSRMEN1KMT2ATLR2
Dl-Tryptophan SCHEMBL28632232 0.82 KDM4E (0.53) GHSRKDM4EMEN1LMNAMPO
Dl-Tryptophan SCHEMBL27344693 0.82 MEN1 (0.48) GHSRKDM4EMEN1LMNAMPO
Dl-Tryptophan SCHEMBL27642185 0.81 MEN1 (0.43) GHSRKDM4EMEN1LMNAMPO
Arginine SCHEMBL17165033 0.81 IL23R (0.40) GHSR

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-5559142-A NUTRIENTS JAROWSKI CHARLES I (US) 1996-09-24 US disclosed