Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.40 |
| ▸ | PDE6D | O43924 | 1/20 | 0.37 |
| ▸ | PDE5A | O76074 | 1/20 | 0.37 |
| ▸ | PDE6A | P16499 | 1/20 | 0.37 |
| ▸ | PDE6G | P18545 | 1/20 | 0.37 |
| ▸ | PDE6B | P35913 | 1/20 | 0.37 |
| ▸ | PDE6C | P51160 | 1/20 | 0.37 |
| ▸ | PDE6H | Q13956 | 1/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 8/20 | 0.35 |
| ▸ | TDO2 | P48775 | 8/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.34 |
| ▸ | ERN1 | O75460 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20727168 | 0.80 | PDE4B (0.43) | PDE4BMAPK1PDE6DPDE5APDE6A | |
| SCHEMBL20727224 | 0.78 | GRIN2B (0.44) | MAPK1 | |
| SCHEMBL20727226 | 0.75 | PDE7A (0.36) | PDE4BIDO1TDO2IRAK4 | |
| SCHEMBL13870222 | 0.72 | PDE4B (0.62) | PDE4BMAPK1PDE6DPDE5APDE6A | |
| SCHEMBL20727202 | 0.71 | PDE4B (0.34) | PDE4BIDO1TDO2 | |
| SCHEMBL1370031 | 0.66 | MAPK1 (0.50) | PDE4BMAPK1PDE6DPDE5APDE6A | |
| SCHEMBL31393227 | 0.66 | IDO1 (0.43) | IDO1TDO2 | |
| SCHEMBL20727164 | 0.66 | IDO1 (0.51) | IDO1TDO2 | |
| SCHEMBL13609371 | 0.65 | PDE4B (0.57) | PDE4BMAPK1PDE6DPDE5APDE6A | |
| SCHEMBL29490927 | 0.64 | MAPK1 (0.45) | PDE4BMAPK1LRRK2ERN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3441388-A1 | 4,5,6-TRI-SUBSTITUTED INDAZOLES DERIVATIVES, PREPARATION THEREOF, AND USE THEREOF IN MEDICINES | Shanghai Haiyan Pharmaceutical Technology Co., Ltd. (CN) | 2019-02-13 | — | — | EP | disclosed |