Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 10/20 | 0.71 |
| ▸ | AURKB | Q96GD4 | 8/20 | 0.71 |
| ▸ | IGF1R | P08069 | 3/20 | 0.59 |
| ▸ | RET | P07949 | 1/20 | 0.56 |
| ▸ | PAK4 | O96013 | 2/20 | 0.55 |
| ▸ | PAK1 | Q13153 | 2/20 | 0.55 |
| ▸ | SRC | P12931 | 5/20 | 0.51 |
| ▸ | GSK3B | P49841 | 5/20 | 0.51 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.50 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.49 |
| ▸ | GSK3A | P49840 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28890857 | 0.89 | AURKA (0.69) | AURKAAURKBRETPAK4PAK1 | |
| SCHEMBL30250298 | 0.85 | AURKA (0.58) | AURKAAURKBIGF1RRETPAK4 | |
| SCHEMBL30250116 | 0.84 | PAK1 (0.70) | AURKAAURKBIGF1RRETPAK4 | |
| SCHEMBL7031171 | 0.81 | IGF1R (0.62) | AURKAAURKBIGF1RPAK4PAK1 | |
| SCHEMBL5255520 | 0.80 | HRH4 (0.65) | AURKAAURKBPAK4PAK1SRC | |
| SCHEMBL1084284 | 0.75 | MAPT (0.59) | MAPTKDM4ETP53 | |
| SCHEMBL30250101 | 0.75 | PAK1 (0.56) | AURKAAURKBIGF1RRETPAK4 | |
| SCHEMBL31471941 | 0.74 | PAK4 (0.71) | AURKBPAK4PAK1SRCGSK3B | |
| SCHEMBL16540275 | 0.74 | IGF1R (0.78) | AURKAAURKBIGF1RPAK4PAK1 | |
| SCHEMBL31471934 | 0.73 | PAK4 (0.65) | AURKBIGF1RPAK4PAK1SRC |
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-111285882-B | Fused ring compound, pharmaceutical composition containing same, and preparation method and application thereof | 四川科伦博泰生物医药股份有限公司 | 2022-12-02 | — | — | CN | disclosed |
| CN-111285882-A | Fused ring compound, pharmaceutical composition containing same, and preparation method and application thereof | 四川科伦博泰生物医药股份有限公司 | 2020-06-16 | — | — | CN | disclosed |