Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 2/20 | 0.38 |
| ▸ | MTOR | P42345 | 2/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.32 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.32 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
| ▸ | CKS1B | P61024 | 1/20 | 0.32 |
| ▸ | SKP1 | P63208 | 1/20 | 0.32 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.32 |
| ▸ | DHODH | Q02127 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | ELANE | P08246 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21847688 | 0.83 | PIK3CA (0.40) | PIK3CAMTORESR2NR1H2MEN1 | |
| SCHEMBL29226277 | 0.82 | PIK3CA (0.39) | PIK3CAMTORESR2NR1H2CHRM4 | |
| SCHEMBL21847679 | 0.82 | ESR2 (0.40) | PIK3CAMTORESR2NR1H2CHRM4 | |
| SCHEMBL21847682 | 0.80 | PIK3CA (0.38) | PIK3CAMTORESR2NR1H2CHRM4 | |
| SCHEMBL23554273 | 0.79 | NR1H2 (0.41) | PIK3CAMTORESR2NR1H2CHRM4 | |
| SCHEMBL21847689 | 0.76 | PIK3CA (0.36) | PIK3CAMTORESR2NR1H2MEN1 | |
| SCHEMBL21847643 | 0.75 | MAPK1 (0.45) | PIK3CAMTORMAPK1DDB1CRBN | |
| SCHEMBL23771943 | 0.69 | KDM4E (0.51) | PIK3CAMTORMEN1KMT2AKDM1A | |
| SCHEMBL29814717 | 0.69 | KDM4E (0.51) | PIK3CAMTORMEN1KMT2AKDM1A | |
| SCHEMBL21461289 | 0.69 | ESR2 (0.53) | PIK3CAMTORESR2NR1H2CHRM4 |
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-117658987-A | Compounds as PLK1 inhibitors, and preparation method and application thereof | 上海深势唯思科技有限责任公司 | 2024-03-08 | — | — | CN | disclosed |