Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | GSK3A | P49840 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | GBA1 | P04062 | 9/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | USP2 | O75604 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28298219 | 0.89 | GSK3A (0.36) | MAPTGSK3AGSK3BGBA1ALDH1A1 | |
| SCHEMBL28028866 | 0.86 | MAPT (0.40) | MAPTGSK3AGSK3BGBA1CYP1A2 | |
| SCHEMBL30662745 | 0.79 | KDM4E (0.43) | MAPTGSK3AGSK3BGBA1CYP1A2 | |
| SCHEMBL301294 | 0.79 | KDM4E (0.43) | MAPTGSK3AGSK3BGBA1CYP1A2 | |
| SCHEMBL28029215 | 0.74 | GSK3A (0.36) | MAPTGSK3AGSK3BGBA1ALDH1A1 | |
| SCHEMBL28142353 | 0.69 | CCNK (0.42) | MAPTGBA1CYP1A2CYP3A4CLK4 | |
| SCHEMBL300899 | 0.67 | CSNK2A1 (0.41) | MAPTGSK3AGSK3BCYP1A2CYP3A4 | |
| SCHEMBL28298285 | 0.66 | NUDT1 (0.43) | MAPTGBA1CYP1A2CYP3A4CLK4 | |
| SCHEMBL28299689 | 0.65 | ALDH1A1 (0.46) | GSK3ACYP1A2CYP3A4CLK4CYP2D6 | |
| SCHEMBL14957526 | 0.65 | MEN1 (0.47) | MAPTALDH1A1CYP19A1CYP11B1CYP11B2 |
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-109846884-A | With TOR kinase inhibitor for treating cancer | 西格诺药品有限公司 | 2019-06-07 | — | — | CN | disclosed |