Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29780101 | 1.00 | SMN1; SMN2 (0.50) | SMN1; SMN2ALDH1A1MAPTRAB9ANPC1 | |
| SCHEMBL28599978 | 0.84 | CA12 (0.47) | SMN1; SMN2ALDH1A1RAB9ANPC1GAA | |
| SCHEMBL26617403 | 0.84 | KDM4E (0.57) | SMN1; SMN2ALDH1A1MAPTRAB9ANPC1 | |
| SCHEMBL29780064 | 0.84 | CA12 (0.47) | SMN1; SMN2ALDH1A1RAB9ANPC1GAA | |
| SCHEMBL4606482 | 0.82 | TDP1 (0.55) | SMN1; SMN2ALDH1A1MAPTRAB9ANPC1 | |
| SCHEMBL10782684 | 0.81 | SMN1; SMN2 (0.52) | SMN1; SMN2ALDH1A1MAPTHPGDKMT2A | |
| SCHEMBL31314406 | 0.81 | SMN1; SMN2 (0.52) | SMN1; SMN2ALDH1A1MAPTHPGDKMT2A | |
| SCHEMBL21262587 | 0.81 | SMN1; SMN2 (0.52) | SMN1; SMN2ALDH1A1MAPTRAB9ANPC1 | |
| SCHEMBL29965600 | 0.81 | SMN1; SMN2 (0.52) | SMN1; SMN2ALDH1A1MAPTRAB9ANPC1 | |
| SCHEMBL3928807 | 0.81 | ALDH1A1 (0.67) | SMN1; SMN2ALDH1A1MAPTRAB9ANPC1 |
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-108430471-B | Factor XIa inhibitors | 默沙东公司 | 2021-07-09 | — | — | CN | disclosed |
| CN-109721613-A | Macro-cyclic amide compound and its pharmaceutical composition and purposes containing quaternary ammonium ion | 四川科伦博泰生物医药股份有限公司 | 2019-05-07 | — | — | CN | disclosed |