Lysine

Lysine

SCHEMBL18263286

C[C@H](N)C(=O)O.NCC(=O)O.NCC(=O)O.NCCCC[C@H](N)C(=O)O.NCCCC[C@H](N)C(=O)O.O=C(O)[C@@H]1CCCN1.O=C(O)[C@@H]1CCCN1

nearest known ligand 0.48

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 17)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.48
DPP7 Q9UHL4 7/20 0.36
DPP4 P27487 4/20 0.36
DPP8 Q6V1X1 3/20 0.36
DPP9 Q86TI2 2/20 0.36
FAP Q12884 1/20 0.34
ITGB3 P05106 2/20 0.34
ITGA2B P08514 2/20 0.34
THRB P10828 1/20 0.33
NOS3 P29474 2/20 0.33
NOS1 P29475 2/20 0.33
NOS2 P35228 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
ARG1 P05089 1/20 0.33
ARG2 P78540 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
Lysine SCHEMBL18259132 1.00 GSR (0.48) GSRDPP7DPP4DPP8DPP9
Lysine SCHEMBL1675274 0.96 GSR (0.51) GSRDPP7DPP4DPP8DPP9
Lysine SCHEMBL5575951 0.96 GSR (0.51) GSRDPP7DPP4DPP8DPP9
Lysine SCHEMBL29069496 0.96 GSR (0.51) GSRDPP7DPP4DPP8DPP9
Lysine SCHEMBL16038745 0.95 GSR (0.53) GSRDPP7DPP4DPP8DPP9
Lysine SCHEMBL22157986 0.95 GSR (0.53) GSRDPP7DPP4DPP8DPP9
Lysine SCHEMBL21796038 0.95 GSR (0.53) GSRDPP7DPP4DPP8DPP9
Lysine SCHEMBL1675387 0.95 GSR (0.53) GSRDPP7DPP4DPP8DPP9
Lysine SCHEMBL6276264 0.95 GSR (0.53) GSRDPP7DPP4DPP8DPP9
Lysine SCHEMBL3094553 0.95 GSR (0.53) GSRDPP7DPP4DPP8DPP9

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-3302577-A1 OPTIMISED MULTIVALENT TARGETING FLUORESCENT TRACER Fluoptics (FR) 2018-04-11 EP disclosed
WO-2016189007-A1 OPTIMISED MULTIVALENT TARGETING FLUORESCENT TRACER FLUOPTICS (FR) 2016-12-01 WO disclosed