Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | RAD51 | Q06609 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL22279199 | 0.88 | NPC1 (0.62) | NPC1RAB9ANPSR1KMT2AMEN1 | |
| SCHEMBL29739633 | 0.87 | NPC1 (0.52) | NPC1RAB9ANPSR1KMT2AMEN1 | |
| SCHEMBL27091711 | 0.87 | NPC1 (0.52) | NPC1RAB9ANPSR1KMT2AMEN1 | |
| SCHEMBL5382561 | 0.85 | NPC1 (0.52) | NPC1RAB9ANPSR1KMT2AMEN1 | |
| SCHEMBL24960688 | 0.85 | NPC1 (0.52) | NPC1RAB9ANPSR1KMT2AMEN1 | |
| SCHEMBL29739599 | 0.84 | NPSR1 (0.61) | NPC1RAB9ANPSR1KMT2AMEN1 | |
| SCHEMBL16907485 | 0.84 | NPSR1 (0.61) | NPC1RAB9ANPSR1KMT2AMEN1 | |
| SCHEMBL9407126 | 0.83 | NPSR1 (0.51) | NPC1RAB9ANPSR1KMT2AMEN1 | |
| SCHEMBL23635744 | 0.82 | NPC1 (0.50) | NPC1RAB9ANPSR1KMT2AMEN1 | |
| SCHEMBL21319206 | 0.82 | RAB9A (0.60) | NPC1RAB9ANPSR1KMT2AMEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114057739-A | Diazepinone derivatives and their use in the treatment of hepatitis b infections | 诺维拉治疗公司 | 2022-02-18 | — | — | CN | disclosed |
| CN-109641896-B | Diazepinone derivatives and their use in the treatment of hepatitis b infections | 诺维拉治疗公司 | 2021-09-21 | — | — | CN | disclosed |
| CN-109641896-A | DIAZEPINONE DERIVATIVES AND THEIR USE IN THE TREATMENT OF HEPATITIS B INFECTIONS | 诺维拉治疗公司 | 2019-04-16 | — | — | CN | disclosed |