Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | AOC1 | P19801 | 3/20 | 0.33 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.32 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.32 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | BCDIN3D | Q7Z5W3 | 1/20 | 0.32 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | P2RX7 | Q99572 | 3/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.31 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19986703 | 0.81 | MAPT (0.38) | MAPTITGB1ITGA4KDM4EMEN1 | |
| SCHEMBL19986722 | 0.79 | ITGB1 (0.45) | MAPTITGB1ITGA4KDM4EMEN1 | |
| SCHEMBL8923850 | 0.77 | MAPT (0.50) | MAPTAOC1ITGB1ITGA4AOC3 | |
| SCHEMBL19986470 | 0.74 | MAPT (0.38) | MAPTITGB1ITGA4KDM4EMEN1 | |
| SCHEMBL28588323 | 0.74 | MAPT (0.42) | MAPTITGB1ITGA4KDM4EP2RX7 | |
| SCHEMBL19986724 | 0.70 | ITGB1 (0.42) | MAPTITGB1ITGA4P2RX7 | |
| SCHEMBL28585046 | 0.67 | MAPT (0.35) | MAPTGAAKMT2AP2RX7 | |
| SCHEMBL15688690 | 0.66 | MAPT (0.41) | MAPTITGB1ITGA4P2RX7 | |
| SCHEMBL16102834 | 0.66 | ALDH1A1 (0.30) | ALDH1A1 | |
| SCHEMBL17372486 | 0.66 | AOC1 (0.57) | MAPTAOC1ITGB1ITGA4AOC3 |
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-2018050110-A1 | NOVEL CAPSID PROTEIN ASSEMBLY INHIBITOR | 正大天晴药业集团股份有限公司 | 2018-03-22 | — | — | WO | disclosed |