Lysine

Lysine

SCHEMBL8035753

NC1CCCCC1.NCCCCC(N)C(=O)O.O=Cc1ccc([N+](=O)[O-])o1

nearest known ligand 0.41

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
GRM8 O00222 1/20 0.41
GRM6 O15303 1/20 0.41
GRM4 Q14833 1/20 0.41
CASP6 P55212 3/20 0.40
RAB9A P51151 2/20 0.39
GSR P00390 1/20 0.39
POLB P06746 3/20 0.37
TDP1 Q9NUW8 3/20 0.37
L3MBTL1 Q9Y468 3/20 0.37
KMT2A Q03164 3/20 0.37
LMNA P02545 3/20 0.36
CYP3A4 P08684 2/20 0.34
HIF1A Q16665 2/20 0.34
KDM4E B2RXH2 2/20 0.34
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
GLO1 Q04760 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
TP53 P04637 1/20 0.34

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 SCHEMBL8035750 1.00 GRM8 (0.41) GRM8GRM6GRM4CASP6RAB9A
Cyclohexylamine SCHEMBL8025520 0.89 CASP6 (0.44) GRM8GRM6GRM4CASP6RAB9A
Cyclohexylamine SCHEMBL8025516 0.89 CASP6 (0.44) GRM8GRM6GRM4CASP6RAB9A
Lysine SCHEMBL8039060 0.84 GSR (0.42) GSRTDP1L3MBTL1ALDH1A1
Lysine SCHEMBL8039058 0.84 GSR (0.42) GSRTDP1L3MBTL1ALDH1A1
Cyclohexylamine SCHEMBL7800901 0.83 CASP6 (0.48) CASP6RAB9APOLBTDP1L3MBTL1
Lysine SCHEMBL8025523 0.83 ALDH1A1 (0.45) GSRPOLBTDP1KMT2AALDH1A1
Lysine SCHEMBL8025526 0.83 ALDH1A1 (0.45) GSRPOLBTDP1KMT2AALDH1A1
Lysine SCHEMBL7803083 0.81 MMP2 (0.43) GRM8GRM6GRM4GSRL3MBTL1
Lysine SCHEMBL7803085 0.81 MMP2 (0.43) GRM8GRM6GRM4GSRL3MBTL1

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