Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | ATR | Q13535 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | CYP46A1 | Q9Y6A2 | 7/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.35 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.35 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28822114 | 0.86 | MAPT (0.47) | MAPTHRH3ATRKDM4EALDH1A1 | |
| SCHEMBL16515417 | 0.82 | MAPT (0.41) | MAPTHRH3ATRKDM4EALDH1A1 | |
| SCHEMBL18269920 | 0.80 | MAPT (0.42) | MAPTHRH3ATRKDM4EALDH1A1 | |
| SCHEMBL16515786 | 0.80 | MAPT (0.40) | MAPTHRH3ATRKDM4EALDH1A1 | |
| SCHEMBL16515552 | 0.80 | MAPT (0.40) | MAPTHRH3ATRKDM4EALDH1A1 | |
| SCHEMBL16515549 | 0.80 | MAPT (0.40) | MAPTHRH3ATRKDM4EALDH1A1 | |
| SCHEMBL15783909 | 0.78 | MAPT (0.52) | MAPTATRKDM4EALDH1A1GAA | |
| SCHEMBL15769958 | 0.77 | NEK2 (0.51) | MAPTATRKDM4EALDH1A1CYP46A1 | |
| SCHEMBL3436045 | 0.77 | CYP3A4 (0.51) | MAPTKDM4EALDH1A1GAACYP46A1 | |
| SCHEMBL15770491 | 0.76 | KDM4E (0.60) | MAPTATRKDM4EALDH1A1GAA |
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-108373476-A | A kind of kinase inhibitor and its preparation and application | 成都地奥制药集团有限公司 | 2018-08-07 | — | — | CN | disclosed |