Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | GFER | P55789 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CFTR | P13569 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL161784 | 0.84 | ALDH1A1 (0.55) | ALDH1A1L3MBTL1MAPTKDM4EGAA | |
| SCHEMBL29505675 | 0.84 | ALDH1A1 (0.55) | ALDH1A1L3MBTL1MAPTKDM4EGAA | |
| Ammonia Solution, Strong SCHEMBL21693609 | 0.82 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1MAPTKDM4EGAA | |
| SCHEMBL378246 | 0.76 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1MAPTKDM4EGAA | |
| Trifluoromethylbenzene SCHEMBL4239834 | 0.75 | TSHR (0.74) | ALDH1A1TSHRMAPK1RAB9ANFE2L2 | |
| SCHEMBL12979851 | 0.75 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1MAPTKDM4EGAA | |
| Hydrochloric Acid SCHEMBL6062984 | 0.74 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1MAPTKDM4EGAA | |
| SCHEMBL330442 | 0.74 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1MAPTKDM4EGAA | |
| SCHEMBL4158192 | 0.73 | CYP3A4 (0.48) | ALDH1A1L3MBTL1MAPTKDM4EPKM | |
| SCHEMBL11689624 | 0.72 | ALDH1A1 (0.48) | ALDH1A1L3MBTL1MAPTKDM4EGAA |
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-108435224-A | The preparation of hafnium C catalyst and its application in benzimidazole parallel projects | 江西科技师范大学 | 2018-08-24 | — | — | CN | disclosed |