Lysine

Lysine

SCHEMBL7800079

NCCCCC(N)C(=O)O.NCCc1ccccc1.O=Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.48

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 19)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.48
MMP2 P08253 2/20 0.44
MMP9 P14780 1/20 0.44
GRIK1 P39086 3/20 0.43
MC4R P32245 1/20 0.42
MC5R P33032 1/20 0.42
MC3R P41968 1/20 0.42
CPB2 Q96IY4 2/20 0.42
GRIK2 Q13002 1/20 0.42
LTA4H P09960 1/20 0.40
ERAP2 Q6P179 1/20 0.40
ERAP1 Q9NZ08 1/20 0.40
LNPEP Q9UIQ6 1/20 0.40
DRD2 P14416 1/20 0.40
DRD4 P21917 1/20 0.40
NOS1 P29475 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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 SCHEMBL7798963 1.00 GSR (0.48) GSRMMP2MMP9GRIK1MC4R
Lysine SCHEMBL7800170 1.00 GSR (0.48) GSRMMP2MMP9GRIK1MC4R
Lysine SCHEMBL7801506 0.99 GSR (0.47) GSRMMP2MMP9GRIK1MC4R
Lysine SCHEMBL7800249 0.97 GSR (0.44) GSRMMP2MMP9GRIK1MC4R
Lysine SCHEMBL7802631 0.97 GSR (0.44) GSRMMP2MMP9GRIK1MC4R
Ornithine Aketoglutarate SCHEMBL7792564 0.96 GRIK1 (0.44) GSRMMP2MMP9GRIK1MC4R
Ornithine SCHEMBL7792563 0.96 GRIK1 (0.44) GSRMMP2MMP9GRIK1MC4R
Lysine SCHEMBL7792521 0.96 GSR (0.43) GSRMMP2MMP9GRIK1MC4R
Lysine SCHEMBL7792523 0.96 GSR (0.43) GSRMMP2MMP9GRIK1MC4R
Ornithine SCHEMBL7798279 0.95 GRIK1 (0.43) GSRMMP2MMP9GRIK1MC4R

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