Lysine

Lysine

SCHEMBL7798140

COc1ccccc1N.NCCCC[C@H](N)C(=O)O.O=Cc1ccc(Cl)cc1Cl

nearest known ligand 0.39

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Known targets — ChEMBL curated mechanism

PPARDPTGS1PTGS2dacAdacBdacCftsImrcAmrcBmrdA

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

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.39
GRIK2 Q13002 1/20 0.39
GRIK3 Q13003 1/20 0.39
GSR P00390 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
SLC1A5 Q15758 7/20 0.38
DRD2 P14416 1/20 0.37
DRD3 P35462 1/20 0.37
ALDH1A1 P00352 1/20 0.35
SUV39H2 Q9H5I1 1/20 0.35
KIF11 P52732 1/20 0.35
ARF6 P62330 1/20 0.35
PTGDR2 Q9Y5Y4 1/20 0.35
LNPEP Q9UIQ6 1/20 0.35
MAPT P10636 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
Lysine SCHEMBL7800225 0.90 SLC1A5 (0.41) GRIK1GRIK2GRIK3GSRTDP1
Lysine SCHEMBL7802115 0.90 SLC1A5 (0.41) GRIK1GRIK2GRIK3GSRTDP1
Lysine SCHEMBL7802117 0.90 SLC1A5 (0.41) GRIK1GRIK2GRIK3GSRTDP1
Lysine SCHEMBL7798151 0.89 TAAR1 (0.42) GRIK1GRIK2GRIK3GSRTDP1
Lysine SCHEMBL7792825 0.89 SLC1A5 (0.40) GRIK1GRIK2GRIK3GSRTDP1
Lysine SCHEMBL7798547 0.89 SLC1A5 (0.40) GRIK1GRIK2GRIK3GSRTDP1
Lysine SCHEMBL7800233 0.88 TDP1 (0.43) GRIK1GRIK2GSRTDP1SLC1A5
Lysine SCHEMBL7793023 0.87 SLC1A5 (0.39) GRIK1GRIK2GRIK3GSRTDP1
Ornithine SCHEMBL7800082 0.87 SLC1A5 (0.41) GRIK1GRIK2GRIK3TDP1SLC1A5
Ornithine Aketoglutarate SCHEMBL7800084 0.87 SLC1A5 (0.41) GRIK1GRIK2GRIK3TDP1SLC1A5

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1076649-A1 ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME TREGA BIOSCIENCES, INC. (US) 2001-02-21 EP disclosed
US-6127381-A A MELANOCORTIN RECEPTOR LIGAND FOR REGULATING FOOD INTAKE AND BODY WEIGHT, REGULATING CYTOKINE ACTIVITY, ANTI-INFLAMMATORY ACTIVITY LION BIOSCIENCE AG (DE) 2000-10-03 US disclosed
WO-1999055679-A1 ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME TREGA BIOSCIENCES, INC. (US) 1999-11-04 WO disclosed