Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.47 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.47 |
| ▸ | ITK | Q08881 | 6/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.33 |
| ▸ | AURKA | O14965 | 2/20 | 0.33 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.33 |
| ▸ | TTK | P33981 | 1/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.33 |
| ▸ | AXL | P30530 | 3/20 | 0.32 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29009499 | 0.86 | AURKA (0.42) | ITKPDPK1AURKAAURKBMAPK10 | |
| SCHEMBL29009507 | 0.83 | HRH1 (0.32) | CYP3A4CYP2D6HRH1KCNH2 | |
| SCHEMBL29009516 | 0.76 | EGFR (0.35) | CYP3A4CYP2D6HRH1KCNH2AURKA | |
| SCHEMBL29009558 | 0.72 | MAPK3 (0.48) | MAPK1MAPK3PDPK1 | |
| SCHEMBL29009534 | 0.71 | HRH1 (0.37) | CYP3A4CYP2D6HRH1KCNH2 | |
| SCHEMBL29009535 | 0.67 | HRH1 (0.35) | MAPK1CYP3A4CYP2D6HRH1KCNH2 | |
| SCHEMBL29009554 | 0.64 | PDPK1 (0.66) | PDPK1 | |
| SCHEMBL30382123 | 0.64 | PDPK1 (0.66) | PDPK1 | |
| SCHEMBL29009505 | 0.62 | MAPK1 (0.59) | MAPK1MAPK3ITKPDPK1 | |
| SCHEMBL29009498 | 0.60 | FGFR1 (0.62) | MAPK1MAPK3PDPK1 |
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-116217551-A | Substituted indazole or azaindazole compounds and application thereof | 河南中医药大学 | 2023-06-06 | — | — | CN | claimed |
| CN-116217551-A | Substituted indazole or azaindazole compounds and application thereof | 河南中医药大学 | 2023-06-06 | — | — | CN | disclosed |