Lysine

Lysine

SCHEMBL8041240

NC1CCCCC1.NCCCC[C@@H](N)C(=O)O.O=C(O)Cc1ccccc1.O=Cc1ccc(-c2ccccc2)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
PTGS1 known ✓ P23219 1/20 0.37
ENPP2 Q13822 1/20 0.39
GSR P00390 1/20 0.38
DRD2 P14416 1/20 0.38
DRD4 P21917 1/20 0.38
ABCC4 O15439 1/20 0.37
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
GRIN1 Q05586 2/20 0.37
GRIN2A Q12879 2/20 0.37
MMP2 P08253 2/20 0.36
MMP9 P14780 1/20 0.36
ACE P12821 2/20 0.36
MC4R P32245 1/20 0.36
MC5R P33032 1/20 0.36
MC3R P41968 1/20 0.36
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 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 SCHEMBL7800559 1.00 ENPP2 (0.39) ENPP2GSRDRD2DRD4ABCC4
Lysine SCHEMBL7800562 1.00 ENPP2 (0.39) ENPP2GSRDRD2DRD4ABCC4
Phenylacetic Acid SCHEMBL7801510 0.97 ENPP2 (0.39) ENPP2GSRDRD2DRD4ABCC4
Phenylacetic Acid SCHEMBL7801513 0.97 ENPP2 (0.39) ENPP2GSRDRD2DRD4ABCC4
Lysine SCHEMBL7800895 0.93 GSR (0.43) GSRDRD2DRD4GRIN1GRIN2A
Lysine SCHEMBL7798348 0.93 GSR (0.43) GSRDRD2DRD4GRIN1GRIN2A
Lysine SCHEMBL7792738 0.93 GSR (0.43) GSRDRD2DRD4GRIN1GRIN2A
Lysine SCHEMBL7792734 0.93 GSR (0.43) GSRDRD2DRD4GRIN1GRIN2A
Lysine SCHEMBL7802269 0.92 GSR (0.41) GSRDRD2DRD4GRIN1GRIN2A
Lysine SCHEMBL7802023 0.92 GSR (0.41) GSRDRD2DRD4GRIN1GRIN2A

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-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