Lysine

Lysine

SCHEMBL4610451

C[C@H](N)C(=O)O.C[C@H](N)C(=O)O.NC(=O)CC[C@H](N)C(=O)Oc1ccc(C[C@H](N)C(=O)O)cc1.NCCCC[C@H](N)C(=O)O

nearest known ligand 0.52

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 19)

geneUniProtsupporting neighboursconfidence
PTGS2 known ✓ P35354 1/20 0.38
PTGS1 known ✓ P23219 1/20 0.37
ITGB3 P05106 4/20 0.52
ITGA2B P08514 4/20 0.52
THRB P10828 1/20 0.46
GSR P00390 1/20 0.42
PTPN1 P18031 1/20 0.40
ALOX15 P16050 1/20 0.40
BLM P54132 1/20 0.40
PMP22 Q01453 1/20 0.40
KMT2A Q03164 1/20 0.40
SLC7A5 Q01650 3/20 0.39
ALPI P09923 1/20 0.37
PKM P14618 1/20 0.37
XIAP P98170 1/20 0.37
MMP2 P08253 1/20 0.37
TPH1 P17752 1/20 0.37
LNPEP Q9UIQ6 1/20 0.37
LTA4H P09960 1/20 0.36

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 SCHEMBL5358311 1.00 ITGB3 (0.52) ITGB3ITGA2BTHRBGSRPTPN1
Lysine SCHEMBL4198912 0.93 ITGB3 (0.53) ITGB3ITGA2BTHRBGSRPTPN1
Glutamic Acid SCHEMBL1696963 0.88 ITGB3 (0.57) ITGB3ITGA2BTHRBGSRPTPN1
Lysine SCHEMBL1921517 0.88 ITGB3 (0.60) ITGB3ITGA2BTHRBGSRPTPN1
SCHEMBL571283 0.88 ITGB3 (0.65) ITGB3ITGA2BTHRBGSRPTPN1
Lysine SCHEMBL3497594 0.87 ITGB3 (0.54) ITGB3ITGA2BTHRBGSRPTPN1
Lysine SCHEMBL1921682 0.87 ITGB3 (0.54) ITGB3ITGA2BTHRBGSRPTPN1
SCHEMBL16972711 0.87 SLC7A5 (0.50) ITGB3ITGA2BPTPN1ALOX15BLM
SCHEMBL1537414 0.87 SLC7A5 (0.50) ITGB3ITGA2BPTPN1ALOX15BLM
Tyrosine SCHEMBL5358316 0.86 SLC7A5 (0.56) ITGB3ITGA2BTHRBGSRALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1498476-B1 MUTATED ALKALINE CELLULASE KAO CORP (JP) 2008-10-15 EP claimed
US-7364891-B2 Mutated alkaline cellulase KAO CORPORATION (JP) 2008-04-29 US claimed
EP-1498476-B1 MUTATED ALKALINE CELLULASE KAO CORP (JP) 2008-10-15 EP disclosed
US-7364891-B2 Mutated alkaline cellulase KAO CORPORATION (JP) 2008-04-29 US disclosed
US-20050287656-A1 Mutated alkaline cellulase KAO CORPORATION (JP) 2005-12-29 US disclosed
EP-1498476-A1 MUTATED ALKALINE CELLULASE Kao Corporation (JP) 2005-01-19 EP disclosed