Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPC6 | Q9Y210 | 3/20 | 0.39 |
| ▸ | HTR6 | P50406 | 2/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | CCR1 | P32246 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29227012 | 1.00 | TRPC6 (0.39) | TRPC6HTR6HTR7DPP4KDM4E | |
| SCHEMBL30900298 | 0.77 | TRPC6 (0.42) | TRPC6HTR6DPP4ALDH1A1CCR1 | |
| SCHEMBL29226248 | 0.77 | MEN1 (0.41) | TRPC6HTR7DPP4ALDH1A1MAPT | |
| SCHEMBL30900288 | 0.77 | MEN1 (0.41) | TRPC6HTR7DPP4ALDH1A1MAPT | |
| SCHEMBL29226353 | 0.77 | TRPC6 (0.42) | TRPC6HTR6DPP4ALDH1A1CCR1 | |
| SCHEMBL29226259 | 0.67 | CHRM4 (0.37) | TRPC6MAPTCCR1SMN1; SMN2 | |
| SCHEMBL30900418 | 0.67 | CHRM4 (0.37) | TRPC6CCR1 | |
| SCHEMBL29226658 | 0.67 | CHRM4 (0.37) | TRPC6CCR1 | |
| SCHEMBL30825164 | 0.67 | CHRM4 (0.37) | TRPC6MAPTCCR1SMN1; SMN2 | |
| SCHEMBL22692223 | 0.66 | CHRNB2 (0.50) | KDM4EALDH1A1MAPTESR2HTR1A |
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 |