Ornithine

Ornithine

SCHEMBL7792961

CC(=O)Nc1ccc(C=O)cc1.COc1ccc(CC(=O)O)cc1.NCCC[C@H](N)C(=O)O.NCCc1ccccc1

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.44
POLB P06746 1/20 0.44
LTA4H P09960 5/20 0.43
ALDH1A1 P00352 2/20 0.43
RAB9A P51151 2/20 0.42
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GAA P10253 1/20 0.40
RECQL P46063 1/20 0.40
MAPK1 P28482 1/20 0.39
KLK7 P49862 1/20 0.39
BCHE P06276 1/20 0.39
ACHE P22303 1/20 0.39
DPP8 Q6V1X1 1/20 0.38
FPR2 P25090 2/20 0.38
ALOX5 P09917 1/20 0.38

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 SCHEMBL7792959 1.00 KDM4E (0.44) KDM4EPOLBLTA4HALDH1A1RAB9A
Lysine SCHEMBL7801523 0.97 LTA4H (0.45) KDM4EPOLBLTA4HALDH1A1RAB9A
Lysine SCHEMBL7801526 0.97 LTA4H (0.45) KDM4EPOLBLTA4HALDH1A1RAB9A
Ornithine SCHEMBL8037246 0.93 KDM4E (0.49) KDM4EPOLBLTA4HALDH1A1RAB9A
Phenylacetic Acid SCHEMBL7798111 0.93 LTA4H (0.42) KDM4EPOLBLTA4HALDH1A1MAPT
Phenylacetic Acid SCHEMBL7798109 0.93 LTA4H (0.42) KDM4EPOLBLTA4HALDH1A1MAPT
Phenylacetic Acid SCHEMBL7798281 0.93 LTA4H (0.42) KDM4EPOLBLTA4HALDH1A1MAPT
P-Anisic Acid SCHEMBL7802573 0.91 LTA4H (0.44) KDM4ELTA4HALDH1A1RAB9AMAPT
P-Anisic Acid SCHEMBL7802570 0.91 LTA4H (0.44) KDM4ELTA4HALDH1A1RAB9AMAPT
Lysine SCHEMBL7800261 0.91 KDM4E (0.48) KDM4EPOLBLTA4HALDH1A1RAB9A

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