Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK2 | O43353 | 8/20 | 0.69 |
| ▸ | ACVR1 | Q04771 | 4/20 | 0.54 |
| ▸ | CDK9 | P50750 | 2/20 | 0.54 |
| ▸ | AURKA | O14965 | 1/20 | 0.54 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.54 |
| ▸ | ABL1 | P00519 | 1/20 | 0.54 |
| ▸ | LCK | P06239 | 1/20 | 0.54 |
| ▸ | MET | P08581 | 1/20 | 0.54 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.54 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.54 |
| ▸ | FLT1 | P17948 | 1/20 | 0.54 |
| ▸ | KDR | P35968 | 1/20 | 0.54 |
| ▸ | FLT3 | P36888 | 1/20 | 0.54 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.54 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.54 |
| ▸ | GSK3A | P49840 | 1/20 | 0.54 |
| ▸ | GSK3B | P49841 | 1/20 | 0.54 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.54 |
| ▸ | MST1R | Q04912 | 1/20 | 0.54 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL18377044 | 1.00 | RIPK2 (0.69) | RIPK2ACVR1CDK9AURKAMAP4K4 | |
| SCHEMBL18376613 | 0.90 | JAK2 (0.59) | RIPK2ACVR1CDK9AURKAMAP4K4 | |
| SCHEMBL18377049 | 0.90 | RIPK2 (0.57) | RIPK2KDRCLK4PTK2JAK2 | |
| SCHEMBL29370809 | 0.87 | PIK3CG (0.60) | RIPK2KDRCDK5CLK4PTK2 | |
| SCHEMBL18377040 | 0.87 | PIK3CG (0.60) | RIPK2KDRCDK5CLK4PTK2 | |
| SCHEMBL18377036 | 0.84 | MAPK10 (0.55) | RIPK2AURKAKDRMAPK8CCNE1 | |
| SCHEMBL29371938 | 0.84 | MAPK10 (0.55) | RIPK2AURKAKDRMAPK8CCNE1 | |
| SCHEMBL18376750 | 0.84 | MAPK10 (0.60) | RIPK2AURKAKDRCDK5PTK2 | |
| SCHEMBL29371294 | 0.84 | MAPK10 (0.60) | RIPK2AURKAKDRCDK5PTK2 | |
| SCHEMBL18376254 | 0.84 | RIPK2 (0.56) | RIPK2CDK9PDGFRBGSK3BJAK2 |
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 3 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 |