Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 17/20 | 0.70 |
| ▸ | KDR | P35968 | 3/20 | 0.70 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.70 |
| ▸ | BRAF | P15056 | 2/20 | 0.70 |
| ▸ | FLT4 | P35916 | 2/20 | 0.70 |
| ▸ | EPHB4 | P54760 | 2/20 | 0.70 |
| ▸ | CIT | O14578 | 1/20 | 0.70 |
| ▸ | GAK | O14976 | 1/20 | 0.70 |
| ▸ | EPHB6 | O15197 | 1/20 | 0.70 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.70 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.70 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.70 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.70 |
| ▸ | RPS6KA4 | O75676 | 1/20 | 0.70 |
| ▸ | STK17B | O94768 | 1/20 | 0.70 |
| ▸ | STK10 | O94804 | 1/20 | 0.70 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.70 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.70 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.70 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.70 |
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 | |
|---|---|---|---|---|
| SCHEMBL28820784 | 1.00 | EGFR (0.70) | EGFRKDRERBB2BRAFFLT4 | |
| SCHEMBL29881905 | 0.92 | EGFR (0.69) | EGFRKDRERBB2BRAFFLT4 | |
| SCHEMBL29881894 | 0.91 | EGFR (0.69) | EGFRKDRERBB2BRAFFLT4 | |
| SCHEMBL29430978 | 0.87 | EGFR (0.69) | EGFRKDRERBB2BRAFFLT4 | |
| SCHEMBL3820465 | 0.87 | EGFR (0.69) | EGFRKDRERBB2BRAFFLT4 | |
| SCHEMBL29881732 | 0.85 | EGFR (0.55) | EGFRKDRERBB2FLT4EPHB4 | |
| SCHEMBL28820840 | 0.85 | EGFR (0.55) | EGFRKDRERBB2FLT4EPHB4 | |
| Gefitinib SCHEMBL29351336 | 0.82 | EGFR (1.00) | EGFRKDRERBB2BRAFFLT4 | |
| Gefitinib SCHEMBL29351046 | 0.82 | EGFR (1.00) | EGFRKDRERBB2BRAFFLT4 | |
| Gefitinib SCHEMBL465143 | 0.82 | EGFR (1.00) | EGFRKDRERBB2BRAFFLT4 |
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-114907261-B | 2-phenylaminoquinoline derivative, preparation method and application thereof | 湖南中医药大学 | 2023-10-27 | — | — | CN | disclosed |
| CN-114907261-A | 2-phenylamino quinoline derivative and preparation method and application thereof | 湖南中医药大学 | 2022-08-16 | — | — | CN | disclosed |