Lysine

Lysine

SCHEMBL7798100

CC(=O)Nc1ccc(C=O)cc1.NCCCCC(N)C(=O)O.NCCc1ccccc1.O=C(O)Cc1ccccc1

nearest known ligand 0.44

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
LTA4H P09960 6/20 0.44
SLC1A3 P43003 1/20 0.39
SLC1A2 P43004 1/20 0.39
SLC1A1 P43005 1/20 0.39
CYP2C9 P11712 1/20 0.39
MMP2 P08253 1/20 0.39
DPP8 Q6V1X1 2/20 0.38
CPA1 P15085 1/20 0.38
CPA2 P48052 1/20 0.38
CPA4 Q9UI42 1/20 0.38
GSR P00390 1/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
DPP4 P27487 1/20 0.37
DPP7 Q9UHL4 1/20 0.37

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 SCHEMBL7798098 1.00 LTA4H (0.44) LTA4HSLC1A3SLC1A2SLC1A1CYP2C9
Phenylacetic Acid SCHEMBL7798111 0.97 LTA4H (0.42) LTA4HSLC1A3SLC1A2SLC1A1CYP2C9
Phenylacetic Acid SCHEMBL7798281 0.97 LTA4H (0.42) LTA4HSLC1A3SLC1A2SLC1A1CYP2C9
Phenylacetic Acid SCHEMBL7798109 0.97 LTA4H (0.42) LTA4HSLC1A3SLC1A2SLC1A1CYP2C9
Lysine SCHEMBL7800181 0.95 LTA4H (0.46) LTA4HSLC1A3SLC1A2SLC1A1MMP2
Lysine SCHEMBL7801413 0.95 LTA4H (0.47) LTA4HSLC1A3SLC1A2SLC1A1CYP2C9
Lysine SCHEMBL7801519 0.95 LTA4H (0.47) LTA4HSLC1A3SLC1A2SLC1A1CYP2C9
Lysine SCHEMBL7801417 0.95 LTA4H (0.47) LTA4HSLC1A3SLC1A2SLC1A1CYP2C9
Lysine SCHEMBL7802634 0.95 KMT2A (0.40) LTA4HSLC1A3SLC1A2SLC1A1CYP2C9
Lysine SCHEMBL7802639 0.95 KMT2A (0.40) LTA4HSLC1A3SLC1A2SLC1A1CYP2C9

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