Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDC25A | P30304 | 2/20 | 0.53 |
| ▸ | CDC25B | P30305 | 2/20 | 0.53 |
| ▸ | CDC25C | P30307 | 2/20 | 0.53 |
| ▸ | DUSP3 | P51452 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | RAB9A | P51151 | 5/20 | 0.50 |
| ▸ | NPC1 | O15118 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | SREBF2 | Q12772 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | HPGDS | O60760 | 1/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29660366 | 0.85 | RAB9A (0.67) | CDC25ACDC25BCDC25CDUSP3MAPT | |
| SCHEMBL29660311 | 0.84 | ALDH1A1 (0.64) | CDC25ACDC25BCDC25CDUSP3MAPT | |
| SCHEMBL22939614 | 0.84 | RAB9A (0.53) | CDC25ACDC25BCDC25CDUSP3MAPT | |
| SCHEMBL22940139 | 0.83 | RAB9A (0.53) | CDC25ACDC25BCDC25CDUSP3MAPT | |
| SCHEMBL23578606 | 0.82 | RAB9A (0.57) | CDC25ACDC25BCDC25CDUSP3MAPT | |
| SCHEMBL29660342 | 0.81 | HPGDS (0.59) | CDC25ACDC25BCDC25CDUSP3MAPT | |
| SCHEMBL22939882 | 0.81 | MMP13 (0.62) | MAPTRAB9ANPC1GAATLR7 | |
| SCHEMBL29911261 | 0.81 | CDC25A (0.46) | CDC25ACDC25BCDC25CDUSP3MAPT | |
| SCHEMBL29911283 | 0.81 | RAB9A (0.51) | CDC25ACDC25BCDC25CDUSP3MAPT | |
| SCHEMBL29660330 | 0.81 | RAB9A (0.50) | CDC25ACDC25BCDC25CDUSP3MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021019051-A1 | INHIBITORS OF HUMAN ATGL | Karl-Franzens-Universität Graz (AT) | 2021-02-04 | — | — | WO | disclosed |