Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.97 |
| ▸ | CYP2E1 | P05181 | 18/20 | 0.74 |
| ▸ | CYP2C8 | P10632 | 18/20 | 0.74 |
| ▸ | CYP2D6 | P10635 | 18/20 | 0.74 |
| ▸ | CYP2C9 | P11712 | 18/20 | 0.74 |
| ▸ | CYP2B6 | P20813 | 18/20 | 0.74 |
| ▸ | CYP2C19 | P33261 | 18/20 | 0.74 |
| ▸ | CYP1A2 | P05177 | 17/20 | 0.74 |
| ▸ | CYP3A4 | P08684 | 16/20 | 0.74 |
| ▸ | BRS3 | P32247 | 1/20 | 0.63 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL8768278 | 0.90 | LMNA (0.79) | LMNACYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL14304388 | 0.85 | CYP2E1 (0.90) | LMNACYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL10492884 | 0.82 | HRH4 (0.70) | LMNACYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL9743301 | 0.81 | CYP2E1 (0.76) | LMNACYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL22468990 | 0.81 | CYP2E1 (1.00) | LMNACYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL12963120 | 0.80 | CYP1A2 (0.67) | LMNACYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL17153978 | 0.78 | CYP2E1 (0.72) | LMNACYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL9512670 | 0.77 | ALDH1A1 (0.83) | LMNAHRH4 | |
| SCHEMBL7672276 | 0.77 | CYP2E1 (0.70) | LMNACYP2E1CYP2C8CYP2D6CYP2C9 | |
| SCHEMBL4650010 | 0.76 | CYP2E1 (1.00) | LMNACYP2E1CYP2C8CYP2D6CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0788795-A1 | PHARMACOLOGICALLY ACTIVE 2-MERCAPTOBENZIMIDAZOLE DERIVATIVES | NAUCHNO-ISSLEDOVATELSKY INSTITUT FARMAKOLOGII AKADEMII MEDITSINSKIKH NAUK (RU) | 1997-08-13 | — | — | EP | disclosed |