Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.44 |
| ▸ | KHK | P50053 | 8/20 | 0.44 |
| ▸ | MPO | P05164 | 1/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | EP300 | Q09472 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31037087 | 0.89 | POLB (0.40) | NPC1RAB9APAX8KHKCYP11B1 | |
| SCHEMBL31037089 | 0.87 | KHK (0.42) | NPC1RAB9APAX8KHKMPO | |
| SCHEMBL31037098 | 0.87 | KHK (0.42) | NPC1RAB9APAX8KHKMPO | |
| SCHEMBL28719142 | 0.86 | CYP11B1 (0.41) | RAB9AKHKCYP11B1CYP11B2ADORA3 | |
| SCHEMBL31037068 | 0.86 | CYP11B1 (0.41) | RAB9AKHKCYP11B1CYP11B2ADORA3 | |
| SCHEMBL31037061 | 0.85 | MAPT (0.41) | GSK3BALDH1A1KDM4ETP53KMT2A | |
| SCHEMBL31037079 | 0.84 | ATM (0.48) | NPC1RAB9APAX8KHKMPO | |
| SCHEMBL31037064 | 0.82 | CA9 (0.45) | NPC1RAB9AKHKALDH1A1APP | |
| SCHEMBL31037057 | 0.81 | MDM2 (0.43) | NPC1RAB9AMPOGSK3BGABRA1 | |
| SCHEMBL31037069 | 0.81 | KHK (0.46) | NPC1RAB9APAX8KHKMPO |
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 |
|---|---|---|---|---|---|---|---|
| CN-113454068-B | Benzonazolone compounds and intermediates thereof | LMITO药业株式会社 | 2024-08-02 | — | — | CN | disclosed |