Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 3/20 | 0.44 |
| ▸ | IRAK4 | Q9NWZ3 | 6/20 | 0.42 |
| ▸ | KIF18A | Q8NI77 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MERTK | Q12866 | 2/20 | 0.39 |
| ▸ | GSK3B | P49841 | 3/20 | 0.39 |
| ▸ | NAPEPLD | Q6IQ20 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.39 |
| ▸ | CDK9 | P50750 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL20205068 | 1.00 | GSK3A (0.44) | GSK3AIRAK4KIF18AMAPK1CYP1A2 | |
| SCHEMBL20205125 | 0.97 | GSK3A (0.47) | GSK3AIRAK4KIF18AMAPK1CYP1A2 | |
| SCHEMBL29939380 | 0.97 | GSK3A (0.47) | GSK3AIRAK4KIF18AMAPK1CYP1A2 | |
| SCHEMBL20204939 | 0.96 | GSK3A (0.44) | GSK3AIRAK4KIF18AMAPK1CYP1A2 | |
| SCHEMBL29939331 | 0.96 | GSK3A (0.44) | GSK3AIRAK4KIF18AMAPK1CYP1A2 | |
| SCHEMBL20205194 | 0.85 | KIF18A (0.43) | GSK3AIRAK4KIF18AMAPK1CYP1A2 | |
| SCHEMBL29939324 | 0.82 | KIF18A (0.48) | GSK3AIRAK4KIF18AMAPK1CYP1A2 | |
| SCHEMBL20205069 | 0.82 | KIF18A (0.48) | GSK3AIRAK4KIF18AMAPK1CYP1A2 | |
| SCHEMBL20189806 | 0.80 | GSK3A (0.63) | GSK3AIRAK4CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL28911737 | 0.79 | GSK3A (0.46) | GSK3AIRAK4GSK3B |
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-110545817-B | GSK-3 inhibitors | 百时美施贵宝公司 | 2022-11-15 | — | — | CN | disclosed |