Lysine

Lysine

SCHEMBL7802671

CC(=O)Nc1ccc(C=O)cc1.NC1CCCCC1.NCCCCC(N)C(=O)O.O=C(O)Cc1ccc(Br)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 15)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 3/20 0.39
DPP4 P27487 2/20 0.39
DPP7 Q9UHL4 2/20 0.39
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
CCR5 P51681 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
ENPP2 Q13822 3/20 0.33
LTA4H P09960 1/20 0.33
KDM4E B2RXH2 3/20 0.33
ALDH1A1 P00352 2/20 0.33
THRB P10828 1/20 0.33
MAPT P10636 1/20 0.33
DHODH Q02127 1/20 0.32

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 SCHEMBL7802667 1.00 DPP8 (0.39) DPP8DPP4DPP7KMT2AMEN1
Ornithine Aketoglutarate SCHEMBL7802612 0.98 KMT2A (0.39) DPP8DPP4DPP7KMT2AMEN1
Ornithine SCHEMBL7802608 0.98 KMT2A (0.39) DPP8DPP4DPP7KMT2AMEN1
Lysine SCHEMBL7793383 0.93 DPP8 (0.41) DPP8DPP4DPP7CCR5LTA4H
Lysine SCHEMBL7802939 0.93 DPP8 (0.41) DPP8DPP4DPP7CCR5LTA4H
Lysine SCHEMBL7793380 0.93 DPP8 (0.41) DPP8DPP4DPP7CCR5LTA4H
Lysine SCHEMBL7800517 0.91 MEN1 (0.45) DPP8DPP4DPP7KMT2AMEN1
Lysine SCHEMBL7801579 0.91 ENPP2 (0.42) KMT2AMEN1NPC1RAB9AENPP2
Lysine SCHEMBL7801581 0.91 ENPP2 (0.42) KMT2AMEN1NPC1RAB9AENPP2
Lysine SCHEMBL7798457 0.91 DPP8 (0.45) DPP8DPP4DPP7NPC1RAB9A

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