Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.44 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CLK1 | P49759 | 8/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.36 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.36 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.33 |
| ▸ | CLK2 | P49760 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | F9 | P00740 | 1/20 | 0.32 |
| ▸ | F10 | P00742 | 1/20 | 0.32 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.32 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL14606240 | 0.83 | ALDH1A1 (0.47) | BACE1CA2CLK1ALDH1A1TP53 | |
| SCHEMBL13790850 | 0.81 | BACE1 (0.45) | BACE1PDE3BPDE3ACA2CLK1 | |
| SCHEMBL144533 | 0.80 | BACE1 (0.65) | BACE1PDE3BPDE3ACA2CLK1 | |
| SCHEMBL3905190 | 0.80 | CYP2A6 (0.47) | BACE1PDE3BPDE3ACA2CLK1 | |
| SCHEMBL13032389 | 0.79 | BACE1 (0.42) | BACE1PDE3BPDE3ACA2ALDH1A1 | |
| SCHEMBL3903263 | 0.78 | CYP2A6 (0.54) | BACE1PDE3BPDE3ACA2CLK1 | |
| SCHEMBL13802155 | 0.78 | BACE1 (0.43) | BACE1PDE3BPDE3ACA2CLK1 | |
| SCHEMBL13802138 | 0.78 | BACE1 (0.40) | BACE1PDE3BPDE3ACA2CLK1 | |
| SCHEMBL13032409 | 0.76 | KDM4E (0.50) | ALDH1A1 | |
| SCHEMBL3911211 | 0.76 | BACE1 (0.41) | BACE1PDE3BPDE3ACA2CLK1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7553867-B2 | Furan or thiophene derivative and medicinal use thereof | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2009-06-30 | — | — | US | disclosed |