Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SQLE | Q14534 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.30 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL11780400 | 0.80 | GSR (0.39) | TRPV1TRPA1 | |
| SCHEMBL13337130 | 0.80 | SPHK1 (0.47) | — | |
| SCHEMBL17570982 | 0.76 | TRPA1 (0.33) | TRPA1 | |
| SCHEMBL27486892 | 0.74 | SQLE (0.36) | SQLESMN1; SMN2ALDH1A1ALOX15TRPA1 | |
| SCHEMBL27094640 | 0.74 | ALDH1A1 (0.35) | SQLESMN1; SMN2ALDH1A1ALOX15 | |
| SCHEMBL27094639 | 0.74 | ALDH1A1 (0.35) | SQLESMN1; SMN2ALDH1A1ALOX15 | |
| SCHEMBL25478676 | 0.73 | — | — | |
| SCHEMBL3912204 | 0.73 | LMNA (0.35) | SQLESMN1; SMN2ALDH1A1ALOX15TRPV1 | |
| SCHEMBL28777499 | 0.73 | SQLE (0.35) | SQLESMN1; SMN2ALDH1A1ALOX15TRPV1 | |
| SCHEMBL28306794 | 0.71 | GABRP (0.36) | ALDH1A1ALOX15 |
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-1204666-A1 | HEXAHYDROPYRROLO[1,2-C]PYRIMIDINES AS ANTIVIRAL, ANTIFUNGAL AND/OR ANTITUMOR AGENTS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2002-05-15 | — | — | EP | disclosed |
| WO-2001000626-A1 | HEXAHYDROPYRROLO[1,2-C]PYRIMIDINES AS ANTIVIRAL, ANTIFUNGAL AND/OR ANTITUMOR AGENTS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2001-01-04 | — | — | WO | disclosed |