Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALK | Q9UM73 | 7/20 | 0.50 |
| ▸ | INSR | P06213 | 6/20 | 0.50 |
| ▸ | IGF1R | P08069 | 6/20 | 0.50 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.50 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.50 |
| ▸ | BRD4 | O60885 | 1/20 | 0.50 |
| ▸ | CDK9 | P50750 | 2/20 | 0.49 |
| ▸ | CCNK | O75909 | 1/20 | 0.49 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.49 |
| ▸ | CDK2 | P24941 | 1/20 | 0.49 |
| ▸ | MAPK3 | P27361 | 3/20 | 0.48 |
| ▸ | EGFR | P00533 | 3/20 | 0.47 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.47 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.47 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.47 |
| ▸ | CDC7 | O00311 | 1/20 | 0.47 |
| ▸ | PLK4 | O00444 | 1/20 | 0.47 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.47 |
| ▸ | AURKA | O14965 | 1/20 | 0.47 |
| ▸ | DCLK1 | O15075 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL29833127 | 0.87 | INSR (0.53) | ALKINSRIGF1RMAPK9MAPK10 | |
| SCHEMBL29833300 | 0.86 | INSR (0.61) | ALKINSRIGF1REGFRLRRK2 | |
| SCHEMBL29833287 | 0.85 | CTSC (0.66) | ALKINSRIGF1RBRD4CDK9 | |
| SCHEMBL29833045 | 0.82 | BRD4 (0.53) | ALKINSRIGF1RBRD4CDK9 | |
| SCHEMBL29833003 | 0.81 | CCNK (0.47) | ALKINSRIGF1RMAPK9MAPK10 | |
| SCHEMBL29833217 | 0.80 | CDK1 (0.51) | ALKINSRMAPK9MAPK10CDK2 | |
| SCHEMBL29833009 | 0.80 | ALK (0.49) | ALKINSRIGF1RCDK9CCNK | |
| SCHEMBL29833012 | 0.79 | ALK (0.49) | ALKINSRIGF1RMAPK9MAPK10 | |
| SCHEMBL29833125 | 0.78 | BCL6 (0.48) | ALKINSRIGF1RMAPK9MAPK10 | |
| SCHEMBL22460086 | 0.77 | ALK (0.66) | ALKINSRIGF1RBRD4EGFR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022199589-A1 | PYRIMIDINE DERIVATIVES | 南京明德新药研发有限公司 | 2022-09-29 | — | — | WO | disclosed |