Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.37 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.37 |
| ▸ | RPS6KA5 | O75582 | 5/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | ATF1 | P18846 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.35 |
| ▸ | RPS6KA4 | O75676 | 1/20 | 0.35 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.35 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL20548870 | 0.84 | RPS6KA5 (0.50) | ROCK1MAPTMAOBRPS6KA5HTR2A | |
| SCHEMBL35210329 | 0.84 | RPS6KA5 (0.50) | ROCK1MAPTMAOBRPS6KA5HTR2A | |
| SCHEMBL31122403 | 0.81 | NOTUM (0.42) | ATF1NFKB1PDGFRB | |
| SCHEMBL30750938 | 0.79 | CDC7 (0.46) | GRM2RPS6KA5CYP19A1RPS6KA4 | |
| SCHEMBL8878531 | 0.79 | KMT2A (0.47) | ROCK1MAPTMEN1KMT2A | |
| SCHEMBL29651176 | 0.79 | RPS6KA5 (0.47) | ROCK1MAPTRPS6KA5RPS6KA4KMT2A | |
| SCHEMBL28617905 | 0.79 | RPS6KA5 (0.47) | ROCK1MAPTRPS6KA5RPS6KA4KMT2A | |
| SCHEMBL30459849 | 0.78 | CA2 (0.38) | ROCK1MAPTMTNR1AMTNR1BGRM2 | |
| SCHEMBL20548967 | 0.73 | ROCK1 (0.72) | ROCK1MAPTMAOBRPS6KA5HTR2A | |
| SCHEMBL28817261 | 0.72 | CDC7 (0.46) | GRM2RPS6KA5CYP19A1RPS6KA4 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117402143-A | EGFR inhibitor and preparation and application thereof | 上海翰森生物医药科技有限公司 | 2024-01-16 | — | — | CN | disclosed |
| CN-117069700-A | EGFR inhibitor and preparation and application thereof | 上海翰森生物医药科技有限公司 | 2023-11-17 | — | — | CN | disclosed |
| CN-111187221-B | EGFR inhibitor and preparation and application thereof | 上海翰森生物医药科技有限公司 | 2023-09-26 | — | — | CN | disclosed |
| CN-111171000-B | EGFR inhibitor and preparation and application thereof | 上海翰森生物医药科技有限公司 | 2023-09-01 | — | — | CN | disclosed |
| CN-111170999-B | EGFR inhibitor and preparation and application thereof | 上海翰森生物医药科技有限公司 | 2023-06-30 | — | — | CN | disclosed |