Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 7/20 | 0.44 |
| ▸ | RAB9A | P51151 | 6/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | FLT3 | P36888 | 1/20 | 0.42 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.42 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.42 |
| ▸ | TACR3 | P29371 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL28585316 | 0.86 | NPC1 (0.46) | NPC1RAB9APKMHTTALDH1A1 | |
| SCHEMBL28580961 | 0.85 | KDM4E (0.50) | GAANPC1RAB9ASMN1; SMN2ADORA3 | |
| SCHEMBL5170938 | 0.74 | ALDH1A1 (0.49) | SMN1; SMN2HTTALDH1A1MEN1KMT2A | |
| SCHEMBL7981944 | 0.71 | PTGIR (0.46) | NPC1RAB9AHTTALDH1A1MEN1 | |
| SCHEMBL8655973 | 0.71 | MEN1 (0.63) | GAANPC1RAB9APKMSMN1; SMN2 | |
| SCHEMBL11080897 | 0.70 | ALDH1A1 (0.51) | GAANPC1RAB9APKMSMN1; SMN2 | |
| SCHEMBL29074099 | 0.70 | MEN1 (0.47) | GAANPC1RAB9APKMSMN1; SMN2 | |
| SCHEMBL626827 | 0.69 | GAA (0.76) | GAANPC1RAB9APKMSMN1; SMN2 | |
| SCHEMBL30071250 | 0.69 | GAA (0.76) | GAANPC1RAB9APKMSMN1; SMN2 | |
| SCHEMBL29655094 | 0.69 | NPC1 (0.60) | GAANPC1RAB9APKMSMN1; SMN2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113135911-B | Method for preparing pyridotriazolone compounds by flow chemistry | 浙江工业大学 | 2022-03-18 | — | — | CN | disclosed |
| CN-113121526-B | Method for preparing pyridotriazolone compounds by oxidation rearrangement | 浙江工业大学 | 2022-03-18 | — | — | CN | disclosed |
| CN-113136594-B | Method for electrochemically synthesizing pyridotriazolone compounds | 浙江工业大学 | 2022-03-15 | — | — | CN | disclosed |
| CN-113136594-A | Method for electrochemically synthesizing pyridotriazolone compounds | 浙江工业大学 | 2021-07-20 | — | — | CN | disclosed |
| CN-113135911-A | Method for preparing pyridotriazolone compounds by flow chemistry | 浙江工业大学 | 2021-07-20 | — | — | CN | disclosed |
| CN-113121526-A | Method for preparing pyridotriazolone compounds by oxidation rearrangement | 浙江工业大学 | 2021-07-16 | — | — | CN | disclosed |