Dl-Phenylalanine

Dl-Phenylalanine

SCHEMBL29067183

CC(C)CC(N)C(=O)O.NC(=O)CCC(N)C(=O)O.NC(CO)C(=O)O.NC(Cc1ccccc1)C(=O)O.NCCCCC(N)C(=O)O.NCCCCC(N)C(=O)O.O=C(O)[C@@H]1CCCN1

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PPARDPTGS1PTGS2dacAdacBdacCftsImrcAmrcBmrdA

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

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PTGS1 known ✓ P23219 1/20 0.35
GHSR Q92847 1/20 0.39
OPRK1 P41145 3/20 0.38
REN P00797 5/20 0.38
THRB P10828 1/20 0.38
PLAU P00749 2/20 0.37
PLAUR Q03405 2/20 0.37
ANPEP P15144 1/20 0.37
RNPEP Q9H4A4 1/20 0.37
DNPEP Q9ULA0 1/20 0.37
MMP2 P08253 1/20 0.35
CTSC P53634 1/20 0.35
ALPI P09923 1/20 0.35
PKM P14618 1/20 0.35
XIAP P98170 1/20 0.35
SLC7A5 Q01650 1/20 0.35

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-Phenylalanine SCHEMBL21925068 0.89 REN (0.41) GHSROPRK1RENANPEPRNPEP
Dl-Phenylalanine SCHEMBL28854621 0.89 OPRK1 (0.42) GHSROPRK1RENTHRBANPEP
Dl-Phenylalanine SCHEMBL20723693 0.88 REN (0.40) OPRK1RENANPEPRNPEPDNPEP
Phenylalanine SCHEMBL28711271 0.87 REN (0.38) GHSROPRK1RENTHRBANPEP
Tyrosine SCHEMBL6246872 0.87 OPRM1 (0.37) GHSRRENTHRBSLC7A5
Phenylalanine SCHEMBL7006272 0.86 OPRK1 (0.39) GHSROPRK1RENTHRBANPEP
Phenylalanine SCHEMBL4287099 0.86 KMT2A (0.37) GHSRTHRBMMP2CTSCALPI
Dl-Phenylalanine SCHEMBL27895092 0.86 REN (0.36) GHSROPRK1RENANPEPRNPEP
Phenylalanine SCHEMBL1836984 0.85 OPRK1 (0.39) GHSROPRK1RENTHRBANPEP
Phenylalanine SCHEMBL3099767 0.85 ALPI (0.48) GHSRTHRBPLAUPLAURMMP2

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
CN-116297970-A Screening method of active substances in complex matrix based on proteolysis peptide library 中山大学 2023-06-23 CN disclosed