Ornithine

Ornithine

SCHEMBL7792718

CCCOc1ccc(C=O)cc1.NCCC[C@H](N)C(=O)O.NCCc1ccccc1

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.48
ITGB3 P05106 2/20 0.46
ITGA2B P08514 2/20 0.46
MAPT P10636 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
LMNA P02545 3/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
PTGES O14684 3/20 0.41
ALOX5 P09917 3/20 0.41
PPARG P37231 3/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
S1PR1 P21453 3/20 0.40

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
Ornithine Aketoglutarate SCHEMBL7792721 1.00 LTA4H (0.48) LTA4HITGB3ITGA2BMAPTSMN1; SMN2
Lysine SCHEMBL7800214 0.97 LTA4H (0.48) LTA4HITGB3ITGA2BMAPTSMN1; SMN2
Lysine SCHEMBL7800211 0.97 LTA4H (0.48) LTA4HITGB3ITGA2BMAPTSMN1; SMN2
Ornithine SCHEMBL7800241 0.97 LTA4H (0.49) LTA4HITGB3ITGA2BMAPTSMN1; SMN2
Ornithine Aketoglutarate SCHEMBL7800245 0.97 LTA4H (0.49) LTA4HITGB3ITGA2BMAPTSMN1; SMN2
Ornithine SCHEMBL7802477 0.95 LTA4H (0.45) LTA4HITGB3ITGA2BMAPTSMN1; SMN2
Phenylacetic Acid SCHEMBL7802702 0.95 LTA4H (0.45) LTA4HITGB3ITGA2BMAPTSMN1; SMN2
Phenylacetic Acid SCHEMBL7802699 0.95 LTA4H (0.45) LTA4HITGB3ITGA2BMAPTSMN1; SMN2
Lysine SCHEMBL7792810 0.94 LTA4H (0.48) LTA4HITGB3ITGA2BMAPTSMN1; SMN2
Lysine SCHEMBL7792811 0.94 LTA4H (0.48) LTA4HITGB3ITGA2BMAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1076649-A1 ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME TREGA BIOSCIENCES, INC. (US) 2001-02-21 EP disclosed
US-6127381-A A MELANOCORTIN RECEPTOR LIGAND FOR REGULATING FOOD INTAKE AND BODY WEIGHT, REGULATING CYTOKINE ACTIVITY, ANTI-INFLAMMATORY ACTIVITY LION BIOSCIENCE AG (DE) 2000-10-03 US disclosed
WO-1999055679-A1 ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME TREGA BIOSCIENCES, INC. (US) 1999-11-04 WO disclosed