Lysine

Lysine

SCHEMBL28434271

NCCCCC(N)C(=O)O.NCCCCC(N)C(=O)O.O=P([O-])([O-])[O-].O=P([O-])([O-])[O-].[Ca+2].[Ca+2].[Ca+2]

nearest known ligand 0.80

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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 19)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.80
ARG2 P78540 4/20 0.50
ARG1 P05089 3/20 0.50
RNPEP Q9H4A4 1/20 0.48
POLB P06746 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
OTC P00480 1/20 0.45
NOS2 P35228 3/20 0.44
NOS3 P29474 2/20 0.44
NOS1 P29475 2/20 0.44
CYP1A2 P05177 2/20 0.44
TSHR P16473 2/20 0.44
CYP3A4 P08684 1/20 0.44
CPB2 Q96IY4 1/20 0.44
GLA P06280 1/20 0.44
NFKB1 P19838 1/20 0.44
APEX1 P27695 1/20 0.44
CYP2C19 P33261 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 SCHEMBL27632944 1.00 GSR (0.80) GSRARG2ARG1RNPEPPOLB
Lysine SCHEMBL30839526 0.96 GSR (0.74) GSRARG2ARG1RNPEPPOLB
Lysine SCHEMBL27653586 0.96 GSR (0.74) GSRARG2ARG1RNPEPPOLB
Lysine SCHEMBL1666691 0.96 GSR (0.80) GSRARG2ARG1RNPEPPOLB
Lysine SCHEMBL1666693 0.96 GSR (0.80) GSRARG2ARG1RNPEPPOLB
Lysine SCHEMBL28010048 0.94 GSR (0.71) GSRARG2ARG1RNPEPOTC
Lysine SCHEMBL11801558 0.92 GSR (0.74) GSRARG2ARG1RNPEPPOLB
Lysine SCHEMBL29050532 0.92 GSR (0.74) GSRARG2ARG1RNPEPPOLB
Lysine SCHEMBL1666689 0.92 GSR (0.74) GSRARG2ARG1RNPEPPOLB
Lysine SCHEMBL28980896 0.92 GSR (0.95) GSRARG2ARG1RNPEPNOS2

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-111548078-A Cement mortar and preparation method thereof 重庆知翔科技有限公司 2020-08-18 CN disclosed