Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 17/20 | 0.68 |
| ▸ | ALK | Q9UM73 | 6/20 | 0.67 |
| ▸ | EML4 | Q9HC35 | 3/20 | 0.67 |
| ▸ | INSR | P06213 | 3/20 | 0.65 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.65 |
| ▸ | ROS1 | P08922 | 1/20 | 0.65 |
| ▸ | FER | P16591 | 1/20 | 0.65 |
| ▸ | LTK | P29376 | 1/20 | 0.65 |
| ▸ | BLK | P51451 | 1/20 | 0.65 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.65 |
| ▸ | BTK | Q06187 | 1/20 | 0.65 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.65 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.65 |
| ▸ | SLK | Q9H2G2 | 1/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.61 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL17059222 | 0.89 | EGFR (0.73) | EGFRALKEML4INSRKCNH2 | |
| SCHEMBL17059193 | 0.86 | EGFR (0.69) | EGFRALKEML4INSRKCNH2 | |
| SCHEMBL28053871 | 0.86 | EGFR (0.75) | EGFRALKINSRERBB2ROS1 | |
| Hydrochloric Acid SCHEMBL28053993 | 0.85 | EGFR (0.74) | EGFRALKINSRERBB2ROS1 | |
| SCHEMBL17059288 | 0.85 | EGFR (0.74) | EGFR | |
| SCHEMBL28053863 | 0.84 | ALK (0.66) | EGFRALKINSRERBB2ROS1 | |
| SCHEMBL28053865 | 0.84 | EGFR (0.83) | EGFRALKINSRERBB2ROS1 | |
| SCHEMBL17059269 | 0.83 | EGFR (0.72) | EGFRALKEML4 | |
| Hydrochloric Acid SCHEMBL28053870 | 0.83 | EGFR (0.82) | EGFRALKINSRERBB2ROS1 | |
| SCHEMBL17059323 | 0.83 | EGFR (0.69) | EGFR |
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-105384694-B | Substituted aminopyrimidine derivative and preparation method and pharmaceutical application thereof | 四川海思科制药有限公司 | 2020-09-04 | — | — | CN | disclosed |
| CN-105384694-A | Substituted aminopyrimidine derivative, preparation method therefor and pharmaceutical application thereof | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2016-03-09 | — | — | CN | disclosed |