Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | HSPB1 | P04792 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL17164751 | 1.00 | TDP1 (0.53) | TDP1ATMALDH1A1MAPTHSPB1 | |
| SCHEMBL221284 | 0.88 | ALDH1A1 (0.61) | TDP1ATMALDH1A1MAPTHSPB1 | |
| SCHEMBL29588929 | 0.88 | ALDH1A1 (0.61) | TDP1ATMALDH1A1MAPTHSPB1 | |
| SCHEMBL8812343 | 0.80 | TDP1 (0.62) | TDP1ATMALDH1A1MAPTHSPB1 | |
| SCHEMBL30184611 | 0.80 | ALDH1A1 (0.43) | TDP1ALDH1A1MAPTLMNAL3MBTL1 | |
| SCHEMBL5495526 | 0.80 | ALDH1A1 (0.51) | TDP1ATMALDH1A1MAPTHSPB1 | |
| SCHEMBL27335613 | 0.77 | TDP1 (0.58) | TDP1ATMALDH1A1MAPTHSPB1 | |
| SCHEMBL20797745 | 0.77 | ALDH1A1 (0.51) | TDP1ATMALDH1A1MAPTHSPB1 | |
| SCHEMBL310522 | 0.77 | MAPT (0.57) | TDP1ATMALDH1A1MAPTHSPB1 | |
| SCHEMBL19178398 | 0.77 | TDP1 (0.53) | TDP1ATMALDH1A1MAPTHSPB1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114829352-B | Novel deuterated pyrimidine derivative and pharmaceutical composition containing same | 昂科比克斯有限公司 | 2024-05-31 | — | — | CN | disclosed |
| EP-4079730-A1 | NOVEL DEUTERIUM-SUBSTITUTED PYRIMIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME | Oncobix Co., Ltd. (KR) | 2022-10-26 | — | — | EP | disclosed |
| CN-114829352-A | Novel deuterated pyrimidine derivative and pharmaceutical composition containing same | 昂科比克斯有限公司 | 2022-07-29 | — | — | CN | disclosed |
| CN-111393377-B | Deuterated pyrimidine derivative with anticancer effect | 四川大学华西医院 | 2022-04-05 | — | — | CN | disclosed |