Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | BCHE | P06276 | 8/20 | 0.32 |
| ▸ | ACHE | P22303 | 8/20 | 0.32 |
| ▸ | NCF1 | P14598 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28921608 | 0.85 | ALDH1A1 (0.35) | ALDH1A1BCHEACHENCF1NOS2 | |
| SCHEMBL22144248 | 0.83 | NCF1 (0.36) | ALDH1A1BCHEACHENCF1NOS2 | |
| SCHEMBL22124414 | 0.75 | ALDH1A1 (0.33) | ALDH1A1MAPT | |
| SCHEMBL22124895 | 0.75 | ALDH1A1 (0.43) | ALDH1A1BCHEACHEMAPTHPGD | |
| SCHEMBL22144102 | 0.74 | PRNP (0.42) | CYP1A2 | |
| SCHEMBL22144263 | 0.73 | ALDH1A1 (0.33) | ALDH1A1MAPT | |
| SCHEMBL22144266 | 0.73 | ALDH1A1 (0.50) | ALDH1A1BCHEACHEMAPTHPGD | |
| SCHEMBL22144095 | 0.71 | MAPT (0.37) | ALDH1A1CYP1A2MAPT | |
| SCHEMBL22125138 | 0.70 | KDM4E (0.35) | ALDH1A1BCHEACHEHPGD | |
| Hydrochloric Acid SCHEMBL22124948 | 0.70 | MAPT (0.36) | ALDH1A1CYP1A2MAPT |
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-113195455-A | Herbicidal cinnolinium compounds | 先正达农作物保护股份公司 | 2021-07-30 | — | — | CN | disclosed |