Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 4/20 | 0.53 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.40 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.37 |
| ▸ | CDK9 | P50750 | 1/20 | 0.37 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.37 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.37 |
| ▸ | MAP3K7 | O43318 | 2/20 | 0.36 |
| ▸ | TAB1 | Q15750 | 2/20 | 0.36 |
| ▸ | BTK | Q06187 | 4/20 | 0.36 |
| ▸ | JAK2 | O60674 | 4/20 | 0.35 |
| ▸ | JAK3 | P52333 | 2/20 | 0.34 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21678497 | 1.00 | PKM (0.53) | PKMMAP2K1CCNT1CDK9CDK5 | |
| SCHEMBL21678385 | 0.83 | PKM (0.53) | PKMMAP2K1CDK9CDK5MAP3K7 | |
| SCHEMBL31070084 | 0.83 | PKM (0.53) | PKMMAP2K1CDK9CDK5MAP3K7 | |
| SCHEMBL30365873 | 0.81 | MAP2K1 (0.56) | PKMMAP2K1JAK2JAK3ALDH1A1 | |
| SCHEMBL22553986 | 0.81 | MAP2K1 (0.56) | PKMMAP2K1JAK2JAK3ALDH1A1 | |
| SCHEMBL30134852 | 0.78 | MAP3K7 (0.45) | PKMMAP2K1CDK9CDK5MAP3K7 | |
| SCHEMBL28994444 | 0.76 | PKM (0.45) | PKMMAP2K1CDK9CDK5JAK2 | |
| SCHEMBL23610513 | 0.75 | PRKCI (0.45) | PKMMAP2K1CDK9CDK5ALDH1A1 | |
| SCHEMBL857339 | 0.74 | PKM (0.42) | PKMMAP2K1CDK9CDK5JAK3 | |
| SCHEMBL21705113 | 0.73 | ROCK2 (0.53) | BTKJAK3 |
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-119080779-A | Pyrrolopyrimidine ITK inhibitors | 阿克拉瑞斯治疗股份有限公司 | 2024-12-06 | — | — | CN | disclosed |
| CN-112823005-B | Pyrrolopyrimidine ITK inhibitors | 阿克拉瑞斯治疗股份有限公司 | 2024-08-20 | — | — | CN | disclosed |