Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | XBP1 | P17861 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | NQO2 | P16083 | 1/20 | 0.38 |
| ▸ | STK17B | O94768 | 1/20 | 0.38 |
| ▸ | STK17A | Q9UEE5 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 4/20 | 0.38 |
| ▸ | CA2 | P00918 | 4/20 | 0.38 |
| ▸ | CA12 | O43570 | 3/20 | 0.38 |
| ▸ | CA9 | Q16790 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28878123 | 0.88 | NUDT1 (0.36) | ATRLMNAALDH1A1GLAHTT | |
| SCHEMBL31569039 | 0.80 | LMNA (0.42) | LMNAHPGDGAAALDH1A1MAPT | |
| SCHEMBL15489572 | 0.79 | ATR (0.45) | ATRLMNAHPGDGAAALDH1A1 | |
| SCHEMBL29967118 | 0.79 | ATR (0.45) | ATRLMNAHPGDGAAALDH1A1 | |
| SCHEMBL30564599 | 0.77 | ATR (0.39) | ATRGAAALDH1A1CA1CA2 | |
| SCHEMBL31569008 | 0.75 | NQO2 (0.39) | ALDH1A1MAPTHTTNPSR1NQO2 | |
| SCHEMBL15489631 | 0.73 | LMNA (0.49) | ATRLMNAHPGDGAAALDH1A1 | |
| SCHEMBL23854699 | 0.72 | MTNR1B (0.41) | HPGDALDH1A1MAPTTP53GLA | |
| SCHEMBL31569482 | 0.71 | STK17B (0.46) | ATRLMNAHPGDGAAALDH1A1 | |
| SCHEMBL6221982 | 0.69 | STK17B (0.52) | ATRLMNAHPGDGAAALDH1A1 |
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-115260180-B | Triazole condensed ring derivative, pharmaceutical composition, preparation method and application thereof | 长春金赛药业有限责任公司 | 2024-05-28 | — | — | CN | disclosed |
| CN-115260180-A | Triazole fused ring containing derivative, pharmaceutical composition, preparation method and application thereof | 长春金赛药业有限责任公司 | 2022-11-01 | — | — | CN | disclosed |