Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AMY1A | P0DUB6 | 13/20 | 0.38 |
| ▸ | PDE5A | O76074 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11306274 | 0.88 | AMY1A (0.43) | AMY1APDE3BPDE3ANPC1PKM | |
| Hydrochloric Acid SCHEMBL11307551 | 0.87 | AMY1A (0.42) | AMY1APDE3BPDE3ANPC1PKM | |
| SCHEMBL7357180 | 0.85 | AMY1A (0.37) | AMY1APDE5APDE3BPDE3AHDAC6 | |
| SCHEMBL7356104 | 0.81 | KDM4E (0.48) | AMY1APDE3BPDE3ACHEK2MAPT | |
| SCHEMBL7352154 | 0.80 | ALDH1A1 (0.48) | NPC1HSP90AA1RAB9AMAPT | |
| SCHEMBL7348936 | 0.79 | AURKA (0.42) | AMY1APDE3BPDE3ACHEK2NPC1 | |
| SCHEMBL7357077 | 0.78 | ABCB11 (0.52) | PDE3BPDE3ACHEK2NPC1PKM | |
| Hydrochloric Acid SCHEMBL11304721 | 0.78 | ABCB11 (0.52) | PDE3BPDE3ACHEK2NPC1PKM | |
| SCHEMBL7347482 | 0.76 | NPC1 (0.46) | AMY1ANPC1PKMRAB9AHDAC6 | |
| SCHEMBL7350293 | 0.76 | NPC1 (0.49) | PDE3BPDE3ANPC1PKMRAB9A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4361563-A | CARDIOTONIC, ANTITHROMBOTIC | DR. KARL THOMAE GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1982-11-30 | — | — | US | disclosed |