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Lysine

Lysine

SCHEMBL28656282

NCCCCC(N)C(=O)O.Nc1ccn([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]2O)c(=O)n1

nearest known ligand 0.61

Full drug profile on Sugi Atlas →

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 4)

geneUniProtsupporting neighboursconfidence
▸ P2RY2 P41231 9/20 0.61
▸ P2RY6 Q15077 13/20 0.59
▸ P2RY4 P51582 6/20 0.57
▸ ST6GAL1 P15907 1/20 0.54

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
SCHEMBL28656278 0.88 P2RY2 (0.53) P2RY2P2RY6P2RY4ST6GAL1
SCHEMBL18785151 0.87 P2RY2 (0.76) P2RY2P2RY6P2RY4
SCHEMBL12595472 0.87 P2RY2 (0.76) P2RY2P2RY6P2RY4
SCHEMBL308618 0.87 P2RY2 (0.76) P2RY2P2RY6P2RY4
SCHEMBL532547 0.87 P2RY2 (0.76) P2RY2P2RY6P2RY4
SCHEMBL29360821 0.87 P2RY2 (0.76) P2RY2P2RY6P2RY4
SCHEMBL154172 0.87 P2RY2 (0.76) P2RY2P2RY6P2RY4
SCHEMBL18785149 0.87 P2RY2 (0.76) P2RY2P2RY6P2RY4
SCHEMBL39904 0.87 P2RY2 (0.76) P2RY2P2RY6P2RY4
SCHEMBL18785150 0.87 P2RY2 (0.76) P2RY2P2RY6P2RY4

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-113423877-A Mutant tRNAs for codon expansion 中外制药株式会社 2021-09-21 — — CN disclosed