Lysine

Lysine

SCHEMBL7803175

NC1CCCCC1.NCCCC[C@H](N)C(=O)O.O=C(O)c1ccccc1.O=Cc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.39

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 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.39
GRIK1 P39086 1/20 0.38
GRIK2 Q13002 1/20 0.38
MC4R P32245 1/20 0.37
DPP7 Q9UHL4 1/20 0.36
BCHE P06276 1/20 0.36
MAOB P27338 1/20 0.36
KMO O15229 1/20 0.36
GSR P00390 1/20 0.36
GRM8 O00222 1/20 0.36
GRM6 O15303 1/20 0.36
GRM4 Q14833 1/20 0.36
ALDH1A1 P00352 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.35
CACNA1B Q00975 1/20 0.35
APBA1 Q02410 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PGR P06401 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
Lysine SCHEMBL7803085 0.94 MMP2 (0.43) MMP2GRIK1GRIK2MC4RGSR
Lysine SCHEMBL7803083 0.94 MMP2 (0.43) MMP2GRIK1GRIK2MC4RGSR
Lysine SCHEMBL7792535 0.92 GRIK1 (0.38) MMP2GRIK1GRIK2MAOBGSR
Lysine SCHEMBL7792529 0.92 GRIK1 (0.38) MMP2GRIK1GRIK2MAOBGSR
Lysine SCHEMBL8039332 0.90 MMP2 (0.41) MMP2GRIK1GRIK2MC4RGSR
Lysine SCHEMBL8025522 0.90 MMP2 (0.41) MMP2GRIK1GRIK2MC4RGSR
Lysine SCHEMBL7800671 0.90 MC4R (0.40) MMP2GRIK1GRIK2MC4RBCHE
Lysine SCHEMBL7800670 0.90 MC4R (0.40) MMP2GRIK1GRIK2MC4RBCHE
Lysine SCHEMBL8041522 0.89 MMP2 (0.40) MMP2GRIK1GRIK2MC4RGSR
Lysine SCHEMBL7802484 0.88 GSR (0.39) MMP2GRIK1GRIK2DPP7GSR

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