Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNK3 | O14649 | 15/20 | 0.55 |
| ▸ | KCNK9 | Q9NPC2 | 15/20 | 0.55 |
| ▸ | SLC2A1 | P11166 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL19807638 | 0.88 | KCNK3 (0.60) | KCNK3KCNK9SLC2A1KDM4EGAA | |
| SCHEMBL22916250 | 0.86 | KCNK3 (0.53) | KCNK3KCNK9SLC2A1KDM4EGAA | |
| Hydrochloric Acid SCHEMBL31448337 | 0.85 | KCNK3 (0.52) | KCNK3KCNK9SLC2A1KDM4EGAA | |
| SCHEMBL22916251 | 0.84 | KDM4E (0.49) | KCNK3KCNK9SLC2A1KDM4EGAA | |
| Hydrochloric Acid SCHEMBL31448517 | 0.83 | KDM4E (0.48) | KCNK3KCNK9SLC2A1KDM4EGAA | |
| SCHEMBL31020924 | 0.81 | KCNK3 (0.64) | KCNK3KCNK9 | |
| SCHEMBL19807628 | 0.81 | KCNK3 (0.64) | KCNK3KCNK9 | |
| SCHEMBL19807774 | 0.81 | KCNK3 (0.52) | KCNK3KCNK9SLC2A1KDM4EGAA | |
| SCHEMBL22635958 | 0.80 | KCNK3 (0.63) | KCNK3KCNK9 | |
| SCHEMBL19807795 | 0.80 | KCNK3 (0.64) | KCNK3KCNK9 |
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-2018015196-A1 | SUBSTITUTED DIAZAHETERO-BICYCLIC COMPOUNDS AND THEIR USE | BAYER AKTIENGESELLSCHAFT (DE) | 2018-01-25 | — | — | WO | disclosed |