Lysine

Lysine

SCHEMBL8025614

COc1cc(C=O)cc([N+](=O)[O-])c1O.NC1CCCCC1.NCCCC[C@H](N)C(=O)O

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 18)

geneUniProtsupporting neighboursconfidence
GRM8 O00222 7/20 0.48
GRM4 Q14833 7/20 0.48
GRM6 O15303 2/20 0.48
GRM7 Q14831 2/20 0.48
POLB P06746 2/20 0.42
GFER P55789 1/20 0.42
EGFR P00533 2/20 0.41
JUN P05412 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPT P10636 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
KMT2A Q03164 1/20 0.39
RAB9A P51151 1/20 0.38
PIM1 P11309 1/20 0.38

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 SCHEMBL8041461 0.86 KDM4E (0.40) GFEREGFRMAPTSMN1; SMN2KDM4E
Cyclohexylamine SCHEMBL7798783 0.86 POLB (0.49) POLBGFEREGFRJUNTDP1
Cyclohexylamine SCHEMBL7798524 0.84 POLB (0.56) POLBGFEREGFRJUNTDP1
Lysine SCHEMBL8037517 0.82 GRM4 (0.43) GRM8GRM4GRM6GRM7
Lysine SCHEMBL8037518 0.82 GRM4 (0.43) GRM8GRM4GRM6GRM7
Isovanillin SCHEMBL8041270 0.81 ALDH1A1 (0.48) POLBTDP1MAPTSMN1; SMN2KDM4E
Isovanillin SCHEMBL8041267 0.81 ALDH1A1 (0.48) POLBTDP1MAPTSMN1; SMN2KDM4E
Lysine SCHEMBL8041446 0.80 GSR (0.43)
Lysine SCHEMBL8041442 0.80 GSR (0.43)
Lysine SCHEMBL8041480 0.79 GSR (0.39) TDP1SMN1; SMN2KDM4EMEN1NPC1

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