Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | TPH1 | P17752 | 1/20 | 0.35 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.34 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.34 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.33 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.33 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | KIT | P10721 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL29710434 | 0.89 | TPH1 (0.41) | SIGMAR1TPH1DGAT1SCN9A | |
| SCHEMBL30446012 | 0.89 | TPH1 (0.41) | SIGMAR1TPH1DGAT1SCN9A | |
| SCHEMBL30445095 | 0.88 | SIGMAR1 (0.38) | SIGMAR1TPH1DGAT1MAPK13MAPK12 | |
| SCHEMBL30446310 | 0.85 | ADK (0.42) | TPH1DGAT1 | |
| SCHEMBL859685 | 0.84 | DGAT1 (0.35) | TPH1DGAT1CYP3A4CYP2D6 | |
| SCHEMBL30446598 | 0.84 | DGAT1 (0.35) | SIGMAR1TPH1DGAT1CYP3A4 | |
| SCHEMBL31089960 | 0.83 | SIGMAR1 (0.40) | SIGMAR1MAPTTPH1DGAT1SCN9A | |
| SCHEMBL99142 | 0.83 | SIGMAR1 (0.40) | SIGMAR1MAPTTPH1DGAT1SCN9A | |
| SCHEMBL19601282 | 0.82 | SIGMAR1 (0.43) | SIGMAR1DGAT1KITSCN9A | |
| SCHEMBL15032966 | 0.81 | TPH1 (0.40) | TPH1DGAT1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116143840-B | Phosphono deazapurine derivative and preparation method and application thereof | 浙江工业大学 | 2024-10-18 | — | — | CN | disclosed |
| CN-116143840-A | Phosphono deazapurine derivative and preparation method and application thereof | 浙江工业大学 | 2023-05-23 | — | — | CN | disclosed |