Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR6 | P51684 | 1/20 | 0.46 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.40 |
| ▸ | PTGIR | P43119 | 1/20 | 0.40 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.40 |
| ▸ | PTPRC | P08575 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 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 | |
|---|---|---|---|---|
| SCHEMBL16379655 | 0.90 | CCR6 (0.47) | CCR6PAX8ALDH1A1KMT2ATDP1 | |
| SCHEMBL801192 | 0.86 | CCR6 (0.54) | CCR6PAX8ALDH1A1KMT2ATDP1 | |
| SCHEMBL7770308 | 0.85 | ALDH1A1 (0.47) | CCR6PAX8ALDH1A1KMT2ATDP1 | |
| SCHEMBL29144368 | 0.84 | ALDH1A1 (0.41) | CCR6PAX8ALDH1A1KMT2ATDP1 | |
| SCHEMBL2787581 | 0.81 | CCR6 (0.50) | CCR6PAX8ALDH1A1KMT2ATDP1 | |
| SCHEMBL11298253 | 0.80 | ALDH1A1 (0.51) | CCR6PAX8ALDH1A1KMT2ATDP1 | |
| SCHEMBL4692471 | 0.79 | ALDH1A1 (0.54) | CCR6PAX8ALDH1A1KMT2ATDP1 | |
| SCHEMBL29144367 | 0.79 | ALDH1A1 (0.46) | CCR6PAX8ALDH1A1KMT2ATDP1 | |
| SCHEMBL28460823 | 0.79 | CCR6 (0.55) | CCR6PAX8ALDH1A1KMT2ATDP1 | |
| SCHEMBL2011988 | 0.79 | ALDH1A1 (0.49) | CCR6PAX8ALDH1A1KMT2ATDP1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025067394-A1 | HALOGEN-SUBSTITUTED EXATECAN AMIDE DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF | 杭州爱科瑞思生物医药有限公司 | 2025-04-03 | — | — | WO | disclosed |
| CN-117417347-A | Halogen-substituted irinotecan amide derivative, preparation method and application thereof | 杭州爱科瑞思生物医药有限公司 | 2024-01-19 | — | — | CN | disclosed |