Lysine

Lysine

SCHEMBL938951

CSCC[C@H](N)C(=O)O.NCCCC[C@H](N)C(=O)O.NCCCC[C@H](N)C(=O)O

nearest known ligand 0.75

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
GSR P00390 1/20 0.71
NOS2 P35228 5/20 0.46
NOS1 P29475 4/20 0.46
NOS3 P29474 3/20 0.46
CYP2C19 P33261 1/20 0.46
THPO P40225 1/20 0.46
BHMT Q93088 3/20 0.46
BHMT2 Q9H2M3 1/20 0.46
ARG2 P78540 4/20 0.46
ARG1 P05089 3/20 0.46
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
TSHR P16473 1/20 0.45
RNPEP Q9H4A4 2/20 0.44
BLM P54132 1/20 0.44

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 SCHEMBL27480207 1.00 GSR (0.71) GSRNOS2NOS1NOS3CYP2C19
Lysine SCHEMBL10491088 1.00 GSR (0.71) GSRNOS2NOS1NOS3CYP2C19
Lysine SCHEMBL1345091 1.00 GSR (0.71) GSRNOS2NOS1NOS3CYP2C19
Lysine SCHEMBL8720001 1.00 GSR (0.71) GSRNOS2NOS1NOS3CYP2C19
Lysine SCHEMBL1345092 1.00 GSR (0.71) GSRNOS2NOS1NOS3CYP2C19
Lysine SCHEMBL6574898 0.98 GSR (0.69) GSRNOS2NOS1NOS3CYP2C19
Lysine SCHEMBL6665159 0.98 GSR (0.69) GSRNOS2NOS1NOS3CYP2C19
Lysine SCHEMBL27579522 0.98 GSR (0.69) GSRNOS2NOS1NOS3CYP2C19
Lysine SCHEMBL6574892 0.98 GSR (0.69) GSRNOS2NOS1NOS3CYP2C19
Lysine SCHEMBL27667352 0.98 GSR (0.69) GSRNOS2NOS1NOS3CYP2C19

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2842575-B1 Auristatin drug linker conjugates SEATTLE GENETICS INC (US) 2017-09-27 EP disclosed
US-9463252-B2 Auristatin drug linker conjugates SEATTLE GENETICS, INC. (US) 2016-10-11 US disclosed
EP-2842575-A1 Auristatin drug linker conjugates Seattle Genetics, Inc. (US) 2015-03-04 EP disclosed
EP-2265283-B1 AURISTATIN DRUG LINKER CONJUGATES SEATTLE GENETICS INC (US) 2014-09-03 EP disclosed
US-20140050746-A1 AURISTATIN DRUG LINKER CONJUGATES SEATTLE GENETICS, INC. (US) 2014-02-20 US disclosed
US-8609105-B2 Auristatin drug linker conjugates SEATTLE GENETICS, INC. (US) 2013-12-17 US disclosed
US-20110020343-A1 AURISTATIN DRUG LINKER CONJUGATES SEATTLE GENETICS, INC. (US) 2011-01-27 US disclosed
US-4837004-A PROTECTIVE POLYMER COATING EASTMAN KODAK COMPANY (US) 1989-06-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110020343-A1 AURISTATIN DRUG LINKER CONJUGATES AURKA, AURKC, AURKB GSR 3767/4885NOS2 3975/4885NOS1 4076/4885
US-20140050746-A1 AURISTATIN DRUG LINKER CONJUGATES AURKA, AURKC, AURKB GSR 3767/4885NOS2 3975/4885NOS1 4076/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.