Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL15004854 | 0.94 | MAPK1 (0.58) | MAPK1MAPTALDH1A1GAAPKM | |
| SCHEMBL15005275 | 0.92 | NPC1 (0.51) | MAPK1MAPTALDH1A1GAAPKM | |
| SCHEMBL16174069 | 0.87 | MAPT (0.67) | MAPK1MAPTALDH1A1GAAHPGD | |
| SCHEMBL28079274 | 0.85 | ALDH1A1 (0.48) | MAPK1MAPTALDH1A1GAAHPGD | |
| SCHEMBL28375421 | 0.85 | MAPK1 (0.53) | MAPK1MAPTALDH1A1PKMHPGD | |
| SCHEMBL16174071 | 0.85 | ALDH1A1 (0.56) | MAPK1MAPTALDH1A1GAAPKM | |
| SCHEMBL15004905 | 0.82 | NPC1 (0.43) | MAPK1MAPTALDH1A1GAAPKM | |
| SCHEMBL15005391 | 0.80 | ALDH1A1 (0.70) | MAPTALDH1A1GAAPKMHPGD | |
| SCHEMBL15005237 | 0.80 | ALDH1A1 (0.69) | MAPK1MAPTALDH1A1GAAHPGD | |
| SCHEMBL15004842 | 0.79 | ALDH1A1 (0.49) | MAPK1MAPTALDH1A1GAAPKM |
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-104011019-B | Azole derivatives | 莱斯特大学 | 2016-08-24 | — | — | CN | disclosed |