Lysine

Lysine

SCHEMBL9167629

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

nearest known ligand 0.36

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 2)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.36
SLC7A5 Q01650 1/20 0.32

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 SCHEMBL28352738 0.92 GSR (0.43) GSRSLC7A5
Lysine SCHEMBL28868906 0.92 GSR (0.43) GSRSLC7A5
Lysine SCHEMBL17685564 0.91 GSR (0.43) GSRSLC7A5
Lysine SCHEMBL27639977 0.88 GSR (0.47) GSR
Lysine SCHEMBL659927 0.88 GSR (0.47) GSR
Lysine SCHEMBL5801871 0.87 GSR (0.37) GSRSLC7A5
Leucine SCHEMBL4616828 0.87 SLC7A5 (0.38) SLC7A5
Lysine SCHEMBL21494167 0.87 GSR (0.48) GSRSLC7A5
Lysine SCHEMBL4450695 0.87 GSR (0.48) GSRSLC7A5
Lysine SCHEMBL20641479 0.87 GSR (0.48) GSRSLC7A5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0654080-A1 PEPTIDES THAT MIMIC gp120 HIV EPITOPE MEDICAL RESEARCH COUNCIL (GB) 1995-05-24 EP claimed
EP-0654080-A1 PEPTIDES THAT MIMIC gp120 HIV EPITOPE MEDICAL RESEARCH COUNCIL (GB) 1995-05-24 EP disclosed
EP-0654080-A1 PEPTIDES THAT MIMIC gp120 HIV EPITOPE MEDICAL RESEARCH COUNCIL (GB) 1995-05-24 EP disclosed
WO-1994002614-A1 PEPTIDES THAT MIMIC gp120 HIV EPITOPE MEDICAL RESEARCH COUNCIL (GB) 1994-02-03 WO disclosed