Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HHAT | Q5VTY9 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7136528 | 0.83 | DRD2 (0.33) | NPC1MAPTRAB9APKMSMN1; SMN2 | |
| SCHEMBL7140884 | 0.83 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL7140885 | 0.81 | HHAT (0.35) | HHATKMT2AALDH1A1MEN1HPGD | |
| SCHEMBL7142274 | 0.79 | DRD4 (0.30) | — | |
| SCHEMBL7138864 | 0.78 | ALDH1A1 (0.35) | ALDH1A1MAPTCYP3A4SMN1; SMN2 | |
| SCHEMBL7145686 | 0.77 | MEN1 (0.31) | KMT2AALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL7135399 | 0.77 | TRPM8 (0.32) | KMT2AMEN1 | |
| SCHEMBL7141405 | 0.77 | F2 (0.32) | ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL7143491 | 0.76 | ALDH1A1 (0.36) | KMT2AALDH1A1NPC1MAPTRAB9A | |
| SCHEMBL7136773 | 0.76 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0966464-B1 | SUBSTITUTED 2,4-DIAMINOPYRIMIDINES | BASILEA PHARMACEUTICA AG (CH) | 2003-05-28 | — | — | EP | disclosed |
| US-6114330-A | BACTERICIDES | HOFFMANN-LA ROCHE INC. (US) | 2000-09-05 | — | — | US | disclosed |
| EP-0966464-A1 | SUBSTITUTED 2,4-DIAMINOPYRIMIDINES | F. HOFFMANN-LA ROCHE AG (CH) | 1999-12-29 | — | — | EP | disclosed |
| WO-1998039328-A1 | SUBSTITUTED 2,4-DIAMINOPYRIMIDINES | F.HOFFMANN-LA ROCHE AG (CH) | 1998-09-11 | — | — | WO | disclosed |