Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | TDO2 | P48775 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | VHL | P40337 | 1/20 | 0.44 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.43 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.43 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.43 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.43 |
| ▸ | F2 | P00734 | 1/20 | 0.41 |
| ▸ | F10 | P00742 | 1/20 | 0.41 |
| ▸ | F7 | P08709 | 1/20 | 0.41 |
| ▸ | F3 | P13726 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | MBNL1 | Q9NR56 | 1/20 | 0.41 |
| ▸ | DHODH | Q02127 | 2/20 | 0.40 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL31469002 | 0.86 | MKNK1 (0.52) | KDM4ETDO2NPC1VHLMKNK1 | |
| SCHEMBL3421959 | 0.86 | MKNK1 (0.52) | KDM4ETDO2NPC1VHLMKNK1 | |
| SCHEMBL113388 | 0.81 | — | — | |
| SCHEMBL29780714 | 0.81 | — | — | |
| SCHEMBL2666043 | 0.80 | NISCH (0.46) | TDO2NPC1VHLMKNK1MKNK2 | |
| SCHEMBL9963986 | 0.80 | NOS3 (0.46) | TDO2NPC1VHLMKNK1MKNK2 | |
| Bromide SCHEMBL27873289 | 0.79 | — | — | |
| SCHEMBL13893237 | 0.79 | TDO2 (0.48) | KDM4ETDO2NPC1VHLGAA | |
| SCHEMBL24391135 | 0.77 | PDE3B (0.46) | KDM4ETDO2MKNK1MKNK2PDE3B | |
| SCHEMBL15698787 | 0.77 | ESR1 (0.49) | KDM4ETDO2MKNK1MKNK2PDE3B |
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-108349989-A | Pyrano bipyridine compound | 卫材R&D管理有限公司 | 2018-07-31 | — | — | CN | disclosed |