Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | GUCY1A1 | Q02108 | 14/20 | 0.42 |
| ▸ | GUCY1B1 | Q02153 | 14/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PDE5A | O76074 | 1/20 | 0.39 |
| ▸ | BUB1 | O43683 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30937506 | 0.89 | ADORA3 (0.50) | ADORA3KCNH2GUCY1A1GUCY1B1KDM4E | |
| SCHEMBL23161959 | 0.89 | ADORA3 (0.50) | ADORA3KCNH2GUCY1A1GUCY1B1KDM4E | |
| SCHEMBL23161951 | 0.89 | KCNH2 (0.49) | ADORA3KCNH2GUCY1A1GUCY1B1PDE5A | |
| SCHEMBL28507109 | 0.87 | GUCY1A1 (0.49) | ADORA3KCNH2GUCY1A1GUCY1B1BUB1 | |
| SCHEMBL28503424 | 0.85 | GUCY1A1 (0.56) | ADORA3KCNH2GUCY1A1GUCY1B1 | |
| SCHEMBL23161910 | 0.85 | ADORA3 (0.46) | ADORA3KCNH2GUCY1A1GUCY1B1PDE5A | |
| SCHEMBL28504551 | 0.84 | ADORA3 (0.37) | ADORA3KCNH2GUCY1A1GUCY1B1ALDH1A1 | |
| SCHEMBL23161992 | 0.83 | ADORA3 (0.48) | ADORA3KCNH2GUCY1A1GUCY1B1 | |
| SCHEMBL23186730 | 0.83 | KCNH2 (0.52) | ADORA3KCNH2GUCY1A1GUCY1B1PDE5A | |
| SCHEMBL23161950 | 0.82 | KCNH2 (0.58) | ADORA3KCNH2GUCY1A1GUCY1B1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108727340-B | Fluorine substituted indazoles and use thereof | 广东东阳光药业有限公司 | 2020-12-29 | — | — | CN | disclosed |