Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPI | P34949 | 8/20 | 0.44 |
| ▸ | G6PD | P11413 | 6/20 | 0.44 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | KAT2A | Q92830 | 3/20 | 0.44 |
| ▸ | KAT2B | Q92831 | 3/20 | 0.44 |
| ▸ | EP300 | Q09472 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | PHOSPHO1 | Q8TCT1 | 5/20 | 0.44 |
| ▸ | PMM2 | O15305 | 4/20 | 0.44 |
| ▸ | APOBEC3G | Q9HC16 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29864457 | 0.87 | MPI (0.57) | MPIG6PDMAPTKDM4EALDH1A1 | |
| SCHEMBL28614657 | 0.87 | MPI (0.57) | MPIG6PDMAPTKDM4EALDH1A1 | |
| SCHEMBL28618907 | 0.85 | MPI (0.44) | MPIG6PDMAPTKDM4EALDH1A1 | |
| SCHEMBL29864756 | 0.85 | MPI (0.44) | MPIG6PDMAPTKDM4EALDH1A1 | |
| SCHEMBL29864650 | 0.83 | G6PD (0.45) | MPIG6PDMAPTKDM4EALDH1A1 | |
| SCHEMBL28618611 | 0.77 | MPI (0.44) | MPIG6PDMAPTKDM4EALDH1A1 | |
| SCHEMBL18845170 | 0.76 | MPI (0.54) | MPIG6PDMAPTKDM4EALDH1A1 | |
| SCHEMBL29864488 | 0.74 | METAP2 (0.44) | MPIG6PDMAPTKDM4EALDH1A1 | |
| SCHEMBL29864440 | 0.69 | MPI (0.54) | MPIG6PDMAPTKDM4EALDH1A1 | |
| SCHEMBL17515281 | 0.67 | MPI (0.59) | MPIG6PDMAPTKDM4EALDH1A1 |
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-113200978-B | Isothia (selenium) azolone derivative and application thereof in anti-coronavirus drugs | 中国海洋大学 | 2022-09-16 | — | — | CN | claimed |
| CN-113200978-B | Isothia (selenium) azolone derivative and application thereof in anti-coronavirus drugs | 中国海洋大学 | 2022-09-16 | — | — | CN | disclosed |