Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 19/20 | 0.71 |
| ▸ | IDO1 | P14902 | 18/20 | 0.71 |
| ▸ | HPGD | P15428 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL22698953 | 0.90 | TDO2 (0.75) | TDO2IDO1HPGDMAPK1HTT | |
| SCHEMBL22699019 | 0.89 | TDO2 (0.72) | TDO2IDO1HPGDMAPK1HTT | |
| SCHEMBL22699005 | 0.87 | TDO2 (0.54) | TDO2IDO1HPGDMAPK1HTT | |
| SCHEMBL22698957 | 0.87 | TDO2 (0.53) | TDO2IDO1HPGDMAPK1HTT | |
| SCHEMBL22699024 | 0.86 | TDO2 (0.55) | TDO2IDO1HPGDMAPK1HTT | |
| SCHEMBL22699020 | 0.86 | TDO2 (0.63) | TDO2IDO1HPGDMAPK1HTT | |
| SCHEMBL22699015 | 0.86 | TDO2 (0.57) | TDO2IDO1HPGDMAPK1HTT | |
| SCHEMBL22699021 | 0.84 | TDO2 (0.58) | TDO2IDO1HPGDMAPK1HTT | |
| SCHEMBL22699008 | 0.84 | TDO2 (0.57) | TDO2IDO1HPGDMAPK1HTT | |
| SCHEMBL22699026 | 0.83 | TDO2 (0.50) | TDO2IDO1HPGDMAPK1HTT |
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-2020232807-A1 | NAPHTHOQUINONE FUSED TRIAZOLE DERIVATIVE, PREPARATION METHOD AND APPLICATION THEREOF | 广州中医药大学(广州中医药研究院) (CN) | 2020-11-26 | — | — | WO | disclosed |