Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 4/20 | 0.68 |
| ▸ | PAX8 | Q06710 | 3/20 | 0.68 |
| ▸ | RAB9A | P51151 | 3/20 | 0.68 |
| ▸ | LMNA | P02545 | 2/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.68 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.68 |
| ▸ | NPC1 | O15118 | 2/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.68 |
| ▸ | TSHR | P16473 | 1/20 | 0.68 |
| ▸ | ATP1A1 | P05023 | 1/20 | 0.68 |
| ▸ | ATP1B1 | P05026 | 1/20 | 0.68 |
| ▸ | ATP1A3 | P13637 | 1/20 | 0.68 |
| ▸ | ATP1B2 | P14415 | 1/20 | 0.68 |
| ▸ | ATP1A2 | P50993 | 1/20 | 0.68 |
| ▸ | ATP12A | P54707 | 1/20 | 0.68 |
| ▸ | ATP1B3 | P54709 | 1/20 | 0.68 |
| ▸ | FXYD2 | P54710 | 1/20 | 0.68 |
| ▸ | ATP1A4 | Q13733 | 1/20 | 0.68 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL21578272 | 1.00 | TP53 (0.68) | TP53PAX8RAB9ALMNASMN1; SMN2 | |
| SCHEMBL11654361 | 1.00 | TP53 (0.68) | TP53PAX8RAB9ALMNASMN1; SMN2 | |
| SCHEMBL61225 | 1.00 | TP53 (0.68) | TP53PAX8RAB9ALMNASMN1; SMN2 | |
| SCHEMBL4905392 | 1.00 | TP53 (0.68) | TP53PAX8RAB9ALMNASMN1; SMN2 | |
| SCHEMBL7309200 | 1.00 | TP53 (0.68) | TP53PAX8RAB9ALMNASMN1; SMN2 | |
| SCHEMBL8999665 | 1.00 | TP53 (0.68) | TP53PAX8RAB9ALMNASMN1; SMN2 | |
| SCHEMBL11806297 | 1.00 | TP53 (0.68) | TP53PAX8RAB9ALMNASMN1; SMN2 | |
| SCHEMBL7279420 | 1.00 | TP53 (0.68) | TP53PAX8RAB9ALMNASMN1; SMN2 | |
| SCHEMBL8830696 | 0.89 | TP53 (0.56) | TP53PAX8RAB9ALMNASMN1; SMN2 | |
| SCHEMBL8830484 | 0.89 | TP53 (0.56) | TP53PAX8RAB9ALMNASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5489582-A | HYPOTENSIVE AGENTS | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNTIE S.P.A (IT) | 1996-02-06 | — | — | US | disclosed |
| EP-0576914-A2 | 14-Deoxy-14-alpha-cardenolides 3-beta-thioderivatives and pharmaceutical composition comprising same for treating cardiovascular disorders | Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) | 1994-01-05 | — | — | EP | disclosed |