Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 3/20 | 0.32 |
| ▸ | AKT1 | P31749 | 3/20 | 0.32 |
| ▸ | AKT2 | P31751 | 3/20 | 0.32 |
| ▸ | AKT3 | Q9Y243 | 3/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.32 |
| ▸ | PRKCA | P17252 | 2/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
| ▸ | SYK | P43405 | 1/20 | 0.32 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | CIT | O14578 | 1/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | PRKCB | P05771 | 1/20 | 0.32 |
| ▸ | PRKACA | P17612 | 1/20 | 0.32 |
| ▸ | PRKACB | P22694 | 1/20 | 0.32 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.32 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.32 |
| ▸ | WDR5 | P61964 | 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 | |
|---|---|---|---|---|
| SCHEMBL28545485 | 1.00 | PIN1 (0.32) | PIN1AKT1AKT2AKT3ROCK1 | |
| SCHEMBL28559733 | 0.95 | PIN1 (0.33) | PIN1AKT1AKT2AKT3ROCK1 | |
| SCHEMBL28559734 | 0.95 | PIN1 (0.33) | PIN1AKT1AKT2AKT3ROCK1 | |
| SCHEMBL28545535 | 0.93 | PIN1 (0.35) | PIN1AKT1AKT2AKT3ROCK1 | |
| SCHEMBL28545536 | 0.93 | PIN1 (0.35) | PIN1AKT1AKT2AKT3ROCK1 | |
| SCHEMBL28559335 | 0.92 | ROCK1 (0.37) | PIN1AKT1AKT2AKT3ROCK1 | |
| SCHEMBL28559331 | 0.92 | ROCK1 (0.37) | PIN1AKT1AKT2AKT3ROCK1 | |
| SCHEMBL28566458 | 0.91 | AKT1 (0.34) | PIN1AKT1AKT2AKT3ROCK1 | |
| SCHEMBL28566460 | 0.91 | AKT1 (0.34) | PIN1AKT1AKT2AKT3ROCK1 | |
| SCHEMBL28554895 | 0.89 | MAPK1 (0.32) | PIN1AKT1AKT2AKT3ROCK1 |
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-112480116-A | PKB inhibitors | 南京正大天晴制药有限公司 | 2021-03-12 | — | — | CN | disclosed |