Lysine

Lysine

SCHEMBL25408697

NCCCCC(N)C(=O)O.c1csc(-c2c[nH]nn2)c1

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
GSR P00390 1/20 0.44
DPP8 Q6V1X1 1/20 0.37
DPP9 Q86TI2 1/20 0.37
DPP7 Q9UHL4 1/20 0.37
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MMP2 P08253 1/20 0.34
ITGB3 P05106 1/20 0.34
ITGA2B P08514 1/20 0.34
LTA4H P09960 1/20 0.34
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
NOS1 P29475 2/20 0.33
THRB P10828 1/20 0.33
GAA P10253 1/20 0.33
HDAC3 O15379 1/20 0.33
HDAC4 P56524 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC7 Q8WUI4 1/20 0.33

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
SCHEMBL31300257 0.72 HDAC3 (0.43) POLBKMT2ATDP1KDM4EALDH1A1
Lysine SCHEMBL28214073 0.70 GSR (0.91) GSRDPP8DPP9DPP7POLB
Lysine SCHEMBL11145520 0.68 GSR (0.71) GSRDPP8DPP9DPP7POLB
Lysine SCHEMBL11145516 0.68 GSR (0.71) GSRDPP8DPP9DPP7POLB
Lysine SCHEMBL1066666 0.68 GSR (0.71) GSRDPP8DPP9DPP7POLB
Lysine SCHEMBL1066668 0.68 GSR (0.71) GSRDPP8DPP9DPP7POLB
Lysine SCHEMBL21635386 0.68 GSR (0.61) GSRDPP8DPP9DPP7ITGB3
Lysine SCHEMBL20362357 0.67 GSR (1.00) GSRKMT2ANOS1SLC1A3SLC1A2
Lysine SCHEMBL12867528 0.67 GSR (1.00) GSRKMT2ANOS1SLC1A3SLC1A2
Lysine SCHEMBL8613373 0.67 GSR (1.00) GSRKMT2ANOS1SLC1A3SLC1A2

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
WO-2023178107-A2 ORTHOGONALLY CROSSLINKED PROTEINS, METHODS OF MAKING, AND USES THEREOF THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2023-09-21 WO disclosed