Ornithine

Ornithine

SCHEMBL7801608

CCCC(=O)Nc1ccc(C=O)cc1.COc1ccc(CC(=O)O)cc1.NC1CCCCC1.NCCC[C@H](N)C(=O)O

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 7/20 0.41
EPHX2 P34913 2/20 0.40
KDM4E B2RXH2 2/20 0.40
POLB P06746 1/20 0.40
MTNR1A P48039 1/20 0.38
MTNR1B P49286 1/20 0.38
LTA4H P09960 4/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37

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 SCHEMBL7801606 1.00 ENPP2 (0.41) ENPP2EPHX2KDM4EPOLBMTNR1A
Lysine SCHEMBL7802577 0.98 ENPP2 (0.41) ENPP2EPHX2KDM4EPOLBMTNR1A
Lysine SCHEMBL7802575 0.98 ENPP2 (0.41) ENPP2EPHX2KDM4EPOLBMTNR1A
Phenylacetic Acid SCHEMBL7792579 0.92 ENPP2 (0.42) ENPP2LTA4HALDH1A1MAPT
Phenylacetic Acid SCHEMBL7792582 0.92 ENPP2 (0.42) ENPP2LTA4HALDH1A1MAPT
Ornithine SCHEMBL7801571 0.91 KDM4E (0.46) KDM4EPOLBMTNR1AMTNR1BLTA4H
Ornithine Aketoglutarate SCHEMBL7802652 0.91 ENPP2 (0.42) ENPP2LTA4HSMN1; SMN2
Ornithine SCHEMBL7802654 0.91 ENPP2 (0.42) ENPP2LTA4HSMN1; SMN2
P-Anisic Acid SCHEMBL7798399 0.91 EPHX2 (0.41) ENPP2EPHX2KDM4EPOLBLTA4H
P-Anisic Acid SCHEMBL7798403 0.91 EPHX2 (0.41) ENPP2EPHX2KDM4EPOLBLTA4H

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 2 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
WO-1999055679-A1 ISOQUINOLINE COMPOUND MELANOCORTIN RECEPTOR LIGANDS AND METHODS OF USING SAME TREGA BIOSCIENCES, INC. (US) 1999-11-04 WO disclosed