Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KIF11 | P52732 | 1/20 | 0.42 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | TNF | P01375 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27565314 | 0.85 | KMT2A (0.52) | KMT2AMEN1KIF11TDP1NPC1 | |
| SCHEMBL9929012 | 0.83 | ACHE (0.54) | KMT2AMEN1TDP1ACHEMAPT | |
| SCHEMBL27282197 | 0.82 | KMT2A (0.57) | KMT2AMEN1TDP1NPC1L3MBTL1 | |
| SCHEMBL5265818 | 0.82 | MEN1 (0.57) | KMT2AMEN1KIF11NPC1RAB9A | |
| SCHEMBL30063441 | 0.82 | MEN1 (0.57) | KMT2AMEN1KIF11NPC1RAB9A | |
| SCHEMBL4780465 | 0.81 | HTR2A (0.39) | KMT2ACHEK2HTR2ASLC6A4KCNH2 | |
| SCHEMBL17355743 | 0.80 | RAB9A (0.42) | KMT2AMEN1HTR2ASLC6A4KCNH2 | |
| SCHEMBL25408607 | 0.79 | KMT2A (0.53) | KMT2AMEN1TDP1NPC1L3MBTL1 | |
| SCHEMBL5693949 | 0.79 | KMT2A (0.53) | KMT2AMEN1KIF11TDP1NPC1 | |
| SCHEMBL29250971 | 0.79 | MEN1 (0.53) | KMT2AMEN1KIF11NPC1RAB9A |
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 2 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 |