Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | ERN1 | O75460 | 2/20 | 0.38 |
| ▸ | SRC | P12931 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14899689 | 0.87 | ALDH1A1 (0.42) | TP53TDP1CYP2A6ALDH1A1KDM4E | |
| SCHEMBL7082497 | 0.87 | TP53 (0.56) | TP53TDP1ALDH1A1TSHRHDAC8 | |
| SCHEMBL3129625 | 0.87 | CYP2A6 (0.52) | CYP2A6ERN1SRCALDH1A1KDM4E | |
| SCHEMBL13381269 | 0.87 | ALDH1A1 (0.42) | TP53TDP1CYP2A6ALDH1A1KDM4E | |
| SCHEMBL280640 | 0.82 | CYP2A6 (0.52) | TDP1CYP2A6ERN1SRCALDH1A1 | |
| SCHEMBL181488 | 0.82 | TP53 (0.56) | TP53TDP1ALDH1A1TSHRHDAC8 | |
| SCHEMBL16439840 | 0.80 | ALDH1A1 (0.36) | TP53TDP1CYP2A6ALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL28065211 | 0.79 | CYP2A6 (0.50) | TDP1CYP2A6ERN1SRCALDH1A1 | |
| Hydrogen Sulfide SCHEMBL29004367 | 0.79 | TP53 (0.54) | TP53TDP1ALDH1A1TSHRHDAC8 | |
| SCHEMBL31039374 | 0.76 | ALDH1A1 (0.46) | ERN1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0126231-B1 | VINYLPHENYL BENZIMIDAZOLE DERIVATIVES, THEIR POLYMERS, THEIR PREPARATION AND USE | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1989-12-20 | — | — | EP | disclosed |
| US-4533678-A | BENZIMIDAZOLYLSTYRENE POLYMERS | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 1985-08-06 | — | — | US | disclosed |
| EP-0126231-A2 | Vinylphenyl benzimidazole derivatives, their polymers, their preparation and use | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1984-11-28 | — | — | EP | disclosed |