Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTK | P33981 | 1/20 | 0.49 |
| ▸ | KIF11 | P52732 | 2/20 | 0.42 |
| ▸ | GSK3B | P49841 | 4/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.36 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | ALDH1A3 | P47895 | 4/20 | 0.34 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.34 |
| ▸ | ALDH3A1 | P30838 | 3/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | TYK2 | P29597 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL15651827 | 1.00 | TTK (0.49) | TTKKIF11GSK3BCYP2A6PDE3B | |
| SCHEMBL182334 | 0.87 | KIF11 (0.42) | TTKKIF11GSK3BCYP2A6ALDH1A1 | |
| SCHEMBL15652838 | 0.84 | TTK (0.49) | TTKKIF11GSK3BCYP2A6PDE3B | |
| SCHEMBL17094915 | 0.84 | TTK (0.44) | TTKKIF11GSK3BCYP2A6ALDH1A1 | |
| SCHEMBL15651369 | 0.81 | TTK (0.47) | TTKKIF11GSK3BCYP2A6ALDH1A1 | |
| SCHEMBL15652140 | 0.78 | TTK (0.52) | TTKKIF11GSK3BCYP2A6ALDH1A1 | |
| SCHEMBL17094906 | 0.77 | GSK3B (0.50) | TTKKIF11GSK3B | |
| SCHEMBL15652215 | 0.77 | TTK (0.46) | TTKKIF11GSK3BCYP2A6ALDH1A1 | |
| SCHEMBL29921339 | 0.77 | TTK (0.49) | TTKKIF11GSK3BCYP2A6 | |
| SCHEMBL29147436 | 0.77 | TTK (0.49) | TTKKIF11GSK3BCYP2A6 |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |