Ornithine

Ornithine

SCHEMBL7800568

CC(=O)Nc1ccc(C=O)cc1.NC1CCCCC1.NCC(=O)O.NCCC[C@H](N)C(=O)O

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1ADORA2AADORA2BADORA3PDE3APDE3BPDE4APDE4BPDE4CPDE4D

The experimentally established mechanism targets of Ornithine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP8 Q6V1X1 2/20 0.41
DPP4 P27487 1/20 0.41
DPP7 Q9UHL4 1/20 0.41
DHODH Q02127 1/20 0.38
KDM4E B2RXH2 3/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 2/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
HTT P42858 1/20 0.36
ENPP2 Q13822 7/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34

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 SCHEMBL7802165 0.97 DPP8 (0.44) DPP8DPP4DPP7DHODHKDM4E
Lysine SCHEMBL7793183 0.97 DPP8 (0.44) DPP8DPP4DPP7DHODHKDM4E
Ornithine SCHEMBL7793059 0.97 DPP8 (0.42) DPP8DPP4DPP7DHODHKDM4E
Ornithine Aketoglutarate SCHEMBL7793056 0.97 DPP8 (0.42) DPP8DPP4DPP7DHODHKDM4E
Ornithine SCHEMBL7798084 0.96 DPP8 (0.42) DPP8DPP4DPP7DHODHKDM4E
Lysine SCHEMBL8041332 0.94 DPP8 (0.46) DPP8DPP4DPP7DHODHKDM4E
Lysine SCHEMBL7798559 0.94 DPP8 (0.46) DPP8DPP4DPP7DHODHKDM4E
Lysine SCHEMBL7792537 0.94 DPP8 (0.46) DPP8DPP4DPP7DHODHKDM4E
Lysine SCHEMBL7798555 0.94 DPP8 (0.46) DPP8DPP4DPP7DHODHKDM4E
Cyclohexylamine SCHEMBL7798160 0.94 DHODH (0.39) DPP8DPP4DPP7DHODHKDM4E

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