Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 13/20 | 0.58 |
| ▸ | BRD4 | O60885 | 4/20 | 0.58 |
| ▸ | JAK3 | P52333 | 10/20 | 0.56 |
| ▸ | PTK2 | Q05397 | 9/20 | 0.56 |
| ▸ | JAK1 | P23458 | 2/20 | 0.56 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.51 |
| ▸ | KDR | P35968 | 1/20 | 0.51 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.49 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.49 |
| ▸ | CDK2 | P24941 | 1/20 | 0.49 |
| ▸ | CDK9 | P50750 | 1/20 | 0.49 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | HTR2A | P28223 | 1/20 | 0.48 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | HTR7 | P34969 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | HTR6 | P50406 | 1/20 | 0.48 |
| ▸ | EGFR | P00533 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL18377030 | 1.00 | JAK2 (0.58) | JAK2BRD4JAK3PTK2JAK1 | |
| SCHEMBL18377076 | 0.91 | JAK2 (0.65) | JAK2BRD4JAK3PTK2JAK1 | |
| SCHEMBL28696326 | 0.91 | JAK2 (0.67) | JAK2BRD4JAK3PTK2JAK1 | |
| SCHEMBL18376753 | 0.91 | PTK2 (0.56) | JAK2BRD4JAK3PTK2JAK1 | |
| SCHEMBL18376247 | 0.91 | BRD4 (0.60) | JAK2BRD4JAK3PTK2JAK1 | |
| SCHEMBL18376846 | 0.90 | JAK2 (0.56) | JAK2BRD4JAK3PTK2CYP3A4 | |
| SCHEMBL18376835 | 0.90 | EGFR (0.58) | JAK2BRD4JAK3PTK2JAK1 | |
| SCHEMBL18376740 | 0.89 | JAK2 (0.57) | JAK2BRD4JAK3PTK2JAK1 | |
| SCHEMBL30859687 | 0.89 | JAK2 (0.57) | JAK2BRD4JAK3PTK2JAK1 | |
| SCHEMBL18376739 | 0.88 | JAK2 (0.54) | JAK2BRD4JAK3PTK2JAK1 |
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-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 |