Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | VNN1 | O95497 | 1/20 | 0.32 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.31 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL755982 | 0.81 | — | — | |
| SCHEMBL26085643 | 0.81 | KDM4E (0.43) | KDM4EALDH1A1SMN1; SMN2HDAC3HDAC1 | |
| SCHEMBL6966444 | 0.81 | POLB (0.37) | KDM4EALDH1A1SMN1; SMN2HDAC3HDAC1 | |
| SCHEMBL6965886 | 0.81 | POLB (0.37) | KDM4EALDH1A1SMN1; SMN2HDAC3HDAC1 | |
| SCHEMBL8105929 | 0.81 | POLB (0.37) | KDM4EALDH1A1SMN1; SMN2HDAC3HDAC1 | |
| SCHEMBL30638522 | 0.76 | KDM4E (0.50) | KDM4EALDH1A1SMN1; SMN2HDAC3HDAC1 | |
| SCHEMBL9474835 | 0.76 | KDM4E (0.50) | KDM4EALDH1A1SMN1; SMN2HDAC3HDAC1 | |
| SCHEMBL8351773 | 0.76 | HSP90AA1 (0.38) | KDM4EALDH1A1SMN1; SMN2HDAC3HDAC1 | |
| SCHEMBL28322787 | 0.74 | DAO (0.38) | KDM4EALDH1A1SMN1; SMN2HDAC3HDAC1 | |
| SCHEMBL10715444 | 0.73 | KDM4E (0.40) | KDM4EALDH1A1SMN1; SMN2HDAC3HDAC1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1704862-A1 | 2,5-bis(tetrahydroxybutyl)pyrazines for the treatment of osteoarthritis and rheumatoid arthritis | Rottapharm S.p.A. (IT) | 2006-09-27 | — | — | EP | disclosed |
| CN-1148178-C | Mixtures obtainable by isolation from seeds of Eugenia jambolana, their preparation, and use of these mixtures and certain components thereof as medicaments | О | 2004-05-05 | — | — | CN | disclosed |
| CN-1080566-C | Mixtures obtainable by isolation from seeds of Eugenia jambolana, their preparation, and use of these mixtures and certain components thereof as medicaments | INST OF MALGACHE DE RECHARCHES (MG) | 2002-03-13 | — | — | CN | disclosed |
| CN-1325685-A | Mixtures obtainable by isolation from seeds of Eugenia jambolana, their preparation, and use of these mixtures and certain components thereof as medicaments | MADAGASCAR APPLIC INC (MG) | 2001-12-12 | — | — | CN | disclosed |
| CN-1210469-A | Mixtures obtainable by isolation from seeds of Eugenia jambolana, their preparation, and use of these mixtures and certain components thereof as medicaments | INST MALGACHE RECH APPL (MG) | 1999-03-10 | — | — | CN | disclosed |