Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.39 |
| ▸ | MMP3 | P08254 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL103468 | 0.92 | ALDH1A1 (0.52) | HPGDALDH1A1GAAHSD11B1POLB | |
| SCHEMBL12367675 | 0.92 | ALDH1A1 (0.52) | HPGDALDH1A1GAAHSD11B1POLB | |
| SCHEMBL10791 | 0.92 | ALDH1A1 (0.52) | HPGDALDH1A1GAAHSD11B1POLB | |
| SCHEMBL2677860 | 0.89 | ALDH1A1 (0.48) | HPGDALDH1A1POLBMAPK1MMP1 | |
| SCHEMBL8951223 | 0.89 | ALDH1A1 (0.48) | HPGDALDH1A1POLBMAPK1MMP1 | |
| SCHEMBL12489264 | 0.82 | ALDH1A1 (0.48) | HPGDALDH1A1GAAPOLBMEN1 | |
| SCHEMBL13448727 | 0.79 | ALDH1A1 (0.41) | HPGDALDH1A1POLBMEN1KMT2A | |
| SCHEMBL28463998 | 0.78 | ALDH1A1 (0.48) | HPGDALDH1A1KMT2AMMP1MMP2 | |
| Diamide SCHEMBL7203941 | 0.76 | ALDH1A1 (0.52) | HPGDALDH1A1POLBMEN1KMT2A | |
| Diamide SCHEMBL7203943 | 0.76 | ALDH1A1 (0.52) | HPGDALDH1A1POLBMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-108218824-A | Diphenyl simultaneously [b, d] oxepane hydride compounds and its preparation and application | 中国科学院大连化学物理研究所 | 2018-06-29 | — | — | CN | disclosed |