Lysine

Lysine

SCHEMBL4667085

CC(C)O.NCCCCC(N)C(=O)O

nearest known ligand 0.83

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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
GSR P00390 1/20 0.83
ARG2 P78540 4/20 0.52
ARG1 P05089 3/20 0.52
NOS2 P35228 6/20 0.50
NOS1 P29475 4/20 0.50
NOS3 P29474 3/20 0.50
CYP1A2 P05177 2/20 0.50
TSHR P16473 2/20 0.50
RNPEP Q9H4A4 1/20 0.50
CYP3A4 P08684 1/20 0.50
BLM P54132 1/20 0.49
CYP2C19 P33261 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CPB2 Q96IY4 1/20 0.46
GLA P06280 1/20 0.46
NFKB1 P19838 1/20 0.46
APEX1 P27695 1/20 0.46

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 SCHEMBL4667086 1.00 GSR (0.83) GSRARG2ARG1NOS2NOS1
Lysine SCHEMBL7706799 0.94 GSR (0.80) GSRARG2ARG1NOS2NOS1
Lysine SCHEMBL30585523 0.94 GSR (0.80) GSRARG2ARG1NOS2NOS1
Lysine SCHEMBL30531666 0.94 GSR (0.80) GSRARG2ARG1NOS2NOS1
Lysine SCHEMBL7706094 0.94 GSR (0.80) GSRARG2ARG1NOS2NOS1
Lysine SCHEMBL15753994 0.92 GSR (0.83) GSRARG2ARG1NOS2NOS1
Lysine SCHEMBL1696587 0.92 GSR (0.83) GSRARG2ARG1NOS2NOS1
Lysine SCHEMBL301792 0.92 GSR (0.83) GSRARG2ARG1NOS2NOS1
Lysine SCHEMBL302610 0.92 GSR (0.83) GSRARG2ARG1NOS2NOS1
Lysine SCHEMBL5581427 0.92 GSR (0.83) GSRARG2ARG1NOS2NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1877403-A1 MONO-LYSINE SALTS OF AZOLE COMPOUNDS Eisai R&D Management Co., Ltd. (JP) 2008-01-16 EP disclosed
WO-2006118351-A1 MONO-LYSINE SALTS OF AZOLE COMPOUNDS EISAI R&D MANAGEMENT CO., LTD. (JP) 2006-11-09 WO disclosed