Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTK | P33981 | 6/20 | 0.60 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.52 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.47 |
| ▸ | EGFR | P00533 | 2/20 | 0.43 |
| ▸ | LCK | P06239 | 3/20 | 0.42 |
| ▸ | SRC | P12931 | 3/20 | 0.42 |
| ▸ | BTK | Q06187 | 2/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | CDK4 | P11802 | 3/20 | 0.40 |
| ▸ | AURKA | O14965 | 2/20 | 0.40 |
| ▸ | KDM1A | O60341 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CCND1 | P24385 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL30002763 | 0.78 | MKNK1 (0.38) | MKNK1 | |
| SCHEMBL28894262 | 0.78 | MKNK1 (0.38) | MKNK1 | |
| SCHEMBL15112625 | 0.76 | FLT3 (0.41) | PTK2EGFRBTKABL1CDK4 | |
| SCHEMBL30001563 | 0.75 | TTK (1.00) | TTKMKNK1PTK2 | |
| SCHEMBL15453521 | 0.75 | EGFR (0.44) | PTK2EGFRBTKCDK4AURKA | |
| SCHEMBL23567042 | 0.74 | JAK2 (0.53) | PTK2EGFRJAK3 | |
| SCHEMBL15112637 | 0.73 | BRD4 (0.44) | PTK2EGFRCDK4CCND3JAK3 | |
| SCHEMBL15459980 | 0.72 | EGFR (0.46) | PTK2EGFRBTKCDK4AURKA | |
| SCHEMBL15126299 | 0.71 | JAK3 (0.53) | EGFRSRCBTKADRA2ATYK2 | |
| SCHEMBL15453518 | 0.71 | JAK3 (0.46) | PTK2EGFRBTKCDK4AURKA |
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-115368364-B | 7H-pyrrolo [2,3-d ] pyrimidine derivatives, preparation method and application thereof | 四川大学 | 2024-07-16 | — | — | CN | disclosed |
| CN-115368364-A | 7H-pyrrolo [2,3-d ] pyrimidine derivative and preparation method and application thereof | 四川大学 | 2022-11-22 | — | — | CN | disclosed |