Lysine

Lysine

SCHEMBL29068869

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

nearest known ligand 0.67

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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 20)

geneUniProtsupporting neighboursconfidence
GSR P00390 2/20 0.67
SLC7A5 Q01650 1/20 0.50
ARG2 P78540 4/20 0.43
ARG1 P05089 3/20 0.43
NOS2 P35228 5/20 0.42
NOS1 P29475 4/20 0.42
NOS3 P29474 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP3A4 P08684 1/20 0.42
TSHR P16473 1/20 0.42
RNPEP Q9H4A4 1/20 0.42
BLM P54132 1/20 0.41
GRM8 O00222 1/20 0.41
GRM6 O15303 1/20 0.41
GRIN2D O15399 1/20 0.41
GRIN3B O60391 1/20 0.41
GRIK1 P39086 1/20 0.41
GRM5 P41594 1/20 0.41
GRIA1 P42261 1/20 0.41
GRIA2 P42262 1/20 0.41

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 SCHEMBL10346457 1.00 GSR (0.67) GSRSLC7A5ARG2ARG1NOS2
Lysine SCHEMBL23162476 1.00 GSR (0.67) GSRSLC7A5ARG2ARG1NOS2
Lysine SCHEMBL3062914 1.00 GSR (0.67) GSRSLC7A5ARG2ARG1NOS2
Lysine SCHEMBL10346746 0.97 GSR (0.62) GSRSLC7A5ARG2ARG1NOS2
Lysine SCHEMBL17112858 0.97 GSR (0.62) GSRSLC7A5ARG2ARG1NOS2
Lysine SCHEMBL9751560 0.97 GSR (0.62) GSRSLC7A5ARG2ARG1NOS2
Lysine SCHEMBL2934512 0.95 GSR (0.74) GSRSLC7A5ARG2ARG1NOS2
Lysine SCHEMBL21494161 0.95 GSR (0.74) GSRSLC7A5ARG2ARG1NOS2
Lysine SCHEMBL429888 0.95 GSR (0.74) GSRSLC7A5ARG2ARG1NOS2
Lysine SCHEMBL429887 0.95 GSR (0.74) GSRSLC7A5ARG2ARG1NOS2

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
CN-116568698-A Linker compounds comprising an amide bond MPEG LA有限责任公司 2023-08-08 CN disclosed