Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.34 |
| ▸ | ACE | P12821 | 1/20 | 0.32 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.32 |
| ▸ | ABAT | P80404 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.30 |
| ▸ | F10 | P00742 | 2/20 | 0.30 |
| ▸ | F2 | P00734 | 1/20 | 0.30 |
| ▸ | KDM1A | O60341 | 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 | |
|---|---|---|---|---|
| SCHEMBL12212988 | 0.74 | NPC1 (0.62) | AKR1C3AKR1C1ALDH1A1NPC1RAB9A | |
| SCHEMBL12212992 | 0.74 | NPC1 (0.62) | AKR1C3AKR1C1ALDH1A1NPC1RAB9A | |
| SCHEMBL12212990 | 0.74 | AKR1C3 (0.56) | AKR1C3AKR1C1ALDH1A1NPC1RAB9A | |
| SCHEMBL12212987 | 0.73 | TRIM24 (0.36) | ALDH1A1ALDH5A1ABAT | |
| SCHEMBL6737724 | 0.72 | SLC6A2 (0.44) | ALDH1A1RAB9AFFAR1ALDH5A1ABAT | |
| SCHEMBL6741298 | 0.72 | SLC6A2 (0.44) | ALDH1A1RAB9AFFAR1ALDH5A1ABAT | |
| SCHEMBL31596735 | 0.70 | CYP2A6 (0.52) | ALDH1A1KDM1A | |
| SCHEMBL6614019 | 0.67 | S1PR4 (0.41) | AKR1C3AKR1C1ALDH1A1NPC1RAB9A | |
| SCHEMBL26455980 | 0.66 | TSHR (0.44) | ALDH1A1KDM1A | |
| SCHEMBL819394 | 0.64 | AKR1C3 (0.65) | AKR1C3AKR1C1ALDH1A1NPC1RAB9A |
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-20110250509-A1 | SECONDARY BATTERY AND ELECTRONIC DEVICE | SONY CORPORATION (JP) | 2011-10-13 | — | — | US | disclosed |