Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | AMY1A | P0DUB6 | 8/20 | 0.35 |
| ▸ | PDE5A | O76074 | 2/20 | 0.35 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.35 |
| ▸ | PDE2A | O00408 | 1/20 | 0.31 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10572968 | 0.93 | NPC1 (0.35) | NPC1RAB9AHSP90AA1PKMAMY1A | |
| SCHEMBL10574093 | 0.87 | AMY1A (0.43) | NPC1RAB9AAMY1APDE5APDE3B | |
| SCHEMBL10575332 | 0.86 | NPC1 (0.36) | NPC1RAB9AHSP90AA1PKMAMY1A | |
| SCHEMBL10695066 | 0.86 | NPC1 (0.40) | NPC1RAB9AHSP90AA1PKMAMY1A | |
| SCHEMBL10580104 | 0.85 | PDE5A (0.45) | NPC1RAB9AAMY1APDE5ASLC2A1 | |
| SCHEMBL10576214 | 0.85 | AMY1A (0.41) | NPC1RAB9AHSP90AA1PKMAMY1A | |
| SCHEMBL10576332 | 0.84 | AMY1A (0.38) | NPC1RAB9AHSP90AA1PKMAMY1A | |
| SCHEMBL10579306 | 0.84 | CDK4 (0.38) | NPC1RAB9AAMY1APDE5APDE3B | |
| SCHEMBL10575604 | 0.84 | PDE5A (0.34) | NPC1RAB9AAMY1APDE5APDE3B | |
| SCHEMBL10578360 | 0.83 | AMY1A (0.34) | NPC1RAB9AAMY1AALDH1A1HPGD |
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-4882342-A | CARDIOVASCULAR DISORDERS | BOEHRINGER MANNHEIM GMBH (DE) | 1989-11-21 | — | — | US | disclosed |