Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 7/20 | 0.53 |
| ▸ | RET | P07949 | 12/20 | 0.50 |
| ▸ | KDR | P35968 | 9/20 | 0.50 |
| ▸ | KIF5B | P33176 | 9/20 | 0.50 |
| ▸ | JAK3 | P52333 | 3/20 | 0.46 |
| ▸ | RIPK2 | O43353 | 2/20 | 0.46 |
| ▸ | GAK | O14976 | 1/20 | 0.46 |
| ▸ | STK10 | O94804 | 1/20 | 0.46 |
| ▸ | FLT3 | P36888 | 1/20 | 0.46 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.46 |
| ▸ | Q6ZSR9 | Q6ZSR9 | 1/20 | 0.46 |
| ▸ | SLK | Q9H2G2 | 1/20 | 0.46 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.46 |
| ▸ | RPS6KA6 | Q9UK32 | 1/20 | 0.46 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.46 |
| ▸ | LCK | P06239 | 1/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.44 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.44 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL216888 | 1.00 | EGFR (0.53) | EGFRRETKDRKIF5BJAK3 | |
| Hydrochloric Acid SCHEMBL28006468 | 0.98 | EGFR (0.52) | EGFRRETKDRKIF5BJAK3 | |
| SCHEMBL7802744 | 0.93 | EGFR (0.53) | EGFRRETKDRKIF5BJAK3 | |
| SCHEMBL2476964 | 0.89 | RET (0.55) | EGFRRETKDRKIF5BJAK3 | |
| Piperidine SCHEMBL4197120 | 0.87 | EGFR (0.44) | EGFRRETKDRKIF5BJAK3 | |
| SCHEMBL12447316 | 0.84 | EGFR (0.52) | EGFRRETKDRKIF5BJAK3 | |
| SCHEMBL20813476 | 0.84 | EGFR (0.52) | EGFRRETKDRKIF5BJAK3 | |
| SCHEMBL16016669 | 0.84 | RET (0.47) | EGFRRETKDRKIF5BJAK3 | |
| SCHEMBL10945990 | 0.83 | EGFR (0.52) | EGFRRETKDRKIF5BJAK3 | |
| SCHEMBL8230611 | 0.83 | EGFR (0.51) | EGFRRETKDRKIF5BJAK3 |
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-110590683-B | Preparation method of intermediate of targeting drug AZD3759 | 山东四环药业股份有限公司 | 2022-08-19 | — | — | CN | claimed |
| CN-110590683-B | Preparation method of intermediate of targeting drug AZD3759 | 山东四环药业股份有限公司 | 2022-08-19 | — | — | CN | disclosed |
| CN-110590683-B | Preparation method of intermediate of targeting drug AZD3759 | 山东四环药业股份有限公司 | 2022-08-19 | — | — | CN | disclosed |
| CN-113307797-B | Polysubstituted quinazoline compound and application thereof | 江南大学 | 2022-08-09 | — | — | CN | disclosed |