Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | TTR | P02766 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 5/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | ALDH2 | P05091 | 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 | |
|---|---|---|---|---|
| SCHEMBL28346151 | 0.78 | MAOB (0.47) | MAPTALDH1A1KDM4ELMNAHPGD | |
| SCHEMBL19182258 | 0.77 | ALDH1A1 (0.44) | MAPTALDH1A1PKMKDM4EHTT | |
| SCHEMBL28349032 | 0.73 | ALDH1A1 (0.48) | MAPTALDH1A1KDM4ELMNAHPGD | |
| SCHEMBL28990341 | 0.71 | ALDH1A1 (0.47) | MAPTALDH1A1PKMKDM4EHTT | |
| SCHEMBL28477936 | 0.71 | ALDH1A1 (0.47) | MAPTALDH1A1PKMKDM4EHTT | |
| SCHEMBL29529294 | 0.69 | PTPN1 (0.77) | MAPTALDH1A1PKMKDM4EHTT | |
| SCHEMBL19182133 | 0.69 | PTPN1 (0.77) | MAPTALDH1A1PKMKDM4EHTT | |
| SCHEMBL21591484 | 0.68 | MAPT (0.44) | MAPTALDH1A1PKMKDM4EHTT | |
| SCHEMBL28600768 | 0.68 | MAPT (0.44) | MAPTALDH1A1PKMKDM4EHTT | |
| SCHEMBL6796169 | 0.67 | MAPT (0.43) | MAPTALDH1A1PKMKDM4EHTT |
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-110563632-B | Electrophilic selenocyanization reagent and preparation method and application thereof | 南宁师范大学 | 2022-11-25 | — | — | CN | disclosed |
| CN-110563632-A | electrophilic selenocyanization reagent and preparation method and application thereof | 南宁师范大学 | 2019-12-13 | — | — | CN | disclosed |