Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 9/20 | 0.39 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 4/20 | 0.36 |
| ▸ | MAOA | P21397 | 3/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3241749 | 0.81 | LMNA (0.42) | ALDH1A1HPGDMAOBMAOACYP2A6 | |
| SCHEMBL9509286 | 0.78 | CYP2A6 (0.41) | TTRALOX5PTGS1PTGS2ALDH1A1 | |
| SCHEMBL69726 | 0.77 | MAOB (0.57) | ALDH1A1HPGDMAOBMAOACYP2A6 | |
| SCHEMBL1987774 | 0.77 | MAOB (0.46) | ALDH1A1KDM4EHPGDMAOBCYP2A6 | |
| SCHEMBL8207446 | 0.76 | TP53 (0.48) | ALOX5PTGS1PTGS2ALDH1A1MAOB | |
| SCHEMBL8097032 | 0.73 | TP53 (0.50) | ALOX5PTGS1PTGS2MAOBMAOA | |
| SCHEMBL12500726 | 0.73 | ALOX5 (0.59) | TTRALOX5PTGS1PTGS2ALDH1A1 | |
| SCHEMBL12500728 | 0.73 | ALOX5 (0.59) | TTRALOX5PTGS1PTGS2ALDH1A1 | |
| Benzaldehyde SCHEMBL28085758 | 0.73 | ALDH1A1 (0.70) | ALOX5ALDH1A1MAOBMAOACYP2A6 | |
| SCHEMBL27969136 | 0.73 | ALOX5 (0.59) | TTRALOX5PTGS1PTGS2ALDH1A1 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1073637-A1 | 3-(AMINO- OR AMINOALKYL)PYRIDINONE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF HIV RELATED DISEASES | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2001-02-07 | — | — | EP | disclosed |
| WO-1999055676-A1 | 3-(AMINO- OR AMINOALKYL)PYRIDINONE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF HIV RELATED DISEASES | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 1999-11-04 | — | — | WO | disclosed |