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Lysine

Lysine

SCHEMBL10754341

NCCCC[C@H](N)C(=O)O.O=[N+]([O-])c1cccc(OP(=O)(O)O)c1[N+](=O)[O-]

nearest known ligand 0.49

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
▸ GRM4 Q14833 13/20 0.49
▸ GRM8 O00222 12/20 0.49
▸ GSR P00390 1/20 0.42
▸ GRM6 O15303 7/20 0.41

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 SCHEMBL28251933 0.85 GSR (0.54) GRM4GRM8GSRGRM6
Lysine SCHEMBL10755723 0.84 GRM4 (0.52) GRM4GRM8GSRGRM6
Lysine SCHEMBL2462408 0.81 GPR35 (0.56) GRM4GRM8GSRGRM6
SCHEMBL11220084 0.80 MMP2 (0.41) GRM4GRM8
SCHEMBL3031094 0.80 MMP2 (0.41) GRM4GRM8
SCHEMBL845400 0.79 GPR35 (0.51) —
SCHEMBL845399 0.79 GPR35 (0.51) —
Lysine SCHEMBL12478274 0.78 GSR (0.46) GRM4GRM8GSRGRM6
Lysine SCHEMBL7542135 0.78 GRM8 (0.56) GRM4GRM8GSRGRM6
Lysine SCHEMBL7548602 0.78 GRM8 (0.56) GRM4GRM8GSRGRM6

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-4687775-A ANTIULCER AGENTS G. D. SEARLE & CO. (US) 1987-08-18 — — US disclosed