Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 4/20 | 0.50 |
| ▸ | JAK3 | P52333 | 4/20 | 0.50 |
| ▸ | CDK1 | P06493 | 2/20 | 0.50 |
| ▸ | KDR | P35968 | 2/20 | 0.50 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.49 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.47 |
| ▸ | TBK1 | Q9UHD2 | 4/20 | 0.46 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.46 |
| ▸ | CSF1R | P07333 | 2/20 | 0.46 |
| ▸ | TYK2 | P29597 | 2/20 | 0.46 |
| ▸ | NUAK1 | O60285 | 1/20 | 0.46 |
| ▸ | STK16 | O75716 | 1/20 | 0.46 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.46 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.46 |
| ▸ | ULK3 | Q6PHR2 | 1/20 | 0.46 |
| ▸ | BMP2K | Q9NSY1 | 1/20 | 0.46 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.44 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.44 |
| ▸ | ULK2 | Q8IYT8 | 2/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28120642 | 0.90 | CDK1 (0.52) | JAK2JAK3CDK1KDRPTK2 | |
| SCHEMBL28673294 | 0.88 | JAK3 (0.51) | JAK2JAK3CDK1KDRPTK2 | |
| SCHEMBL28680804 | 0.86 | TTK (0.53) | JAK2JAK3PTK2MAPK10BRD4 | |
| SCHEMBL28674130 | 0.85 | CDK1 (0.54) | JAK2JAK3CDK1KDRPTK2 | |
| SCHEMBL28120634 | 0.84 | CDK1 (0.53) | JAK2JAK3CDK1KDRPTK2 | |
| SCHEMBL18376765 | 0.83 | JAK2 (0.56) | JAK2JAK3CDK1KDRPTK2 | |
| SCHEMBL18376759 | 0.83 | MAPK10 (0.53) | JAK2JAK3CDK1KDRPTK2 | |
| SCHEMBL18376853 | 0.82 | JAK3 (0.58) | JAK2JAK3CDK1KDRPTK2 | |
| SCHEMBL28120297 | 0.82 | JAK2 (0.61) | JAK2JAK3CDK1KDRPTK2 | |
| SCHEMBL18377062 | 0.81 | JAK3 (0.56) | JAK2JAK3CDK1KDRPTK2 |
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-113999180-A | Quinazoline compound, intermediate thereof, preparation method, pharmaceutical composition and application | 上海医药集团股份有限公司 | 2022-02-01 | — | — | CN | claimed |
| CN-113999180-B | Quinazoline compound, intermediate, preparation method, pharmaceutical composition and application | 上海医药集团股份有限公司 | 2024-03-26 | — | — | CN | disclosed |
| CN-113999180-A | Quinazoline compound, intermediate thereof, preparation method, pharmaceutical composition and application | 上海医药集团股份有限公司 | 2022-02-01 | — | — | CN | disclosed |
| CN-106316965-B | Quinazoline compound, intermediate thereof, preparation method, pharmaceutical composition and application | 上海医药集团股份有限公司 | 2021-08-27 | — | — | CN | disclosed |