Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRS3 | P32247 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 9/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 9/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 9/20 | 0.48 |
| ▸ | CYP2E1 | P05181 | 8/20 | 0.48 |
| ▸ | CYP2C8 | P10632 | 8/20 | 0.48 |
| ▸ | CYP2B6 | P20813 | 8/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.48 |
| ▸ | ATP1A1 | P05023 | 3/20 | 0.47 |
| ▸ | ATP1B1 | P05026 | 3/20 | 0.47 |
| ▸ | ATP1A3 | P13637 | 3/20 | 0.47 |
| ▸ | ATP1B2 | P14415 | 3/20 | 0.47 |
| ▸ | ATP4A | P20648 | 3/20 | 0.47 |
| ▸ | ATP1A2 | P50993 | 3/20 | 0.47 |
| ▸ | ATP4B | P51164 | 3/20 | 0.47 |
| ▸ | ATP1B3 | P54709 | 3/20 | 0.47 |
| ▸ | FXYD2 | P54710 | 3/20 | 0.47 |
| ▸ | ATP1A4 | Q13733 | 3/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.46 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10371942 | 0.94 | BRS3 (0.49) | BRS3CYP2D6CYP2C9CYP2C19CYP2E1 | |
| SCHEMBL10370611 | 0.91 | ATP4A (0.49) | BRS3CYP2D6CYP2C9CYP2C19CYP2E1 | |
| SCHEMBL6882439 | 0.90 | BRS3 (0.57) | BRS3CYP2D6CYP2C9CYP2C19CYP2E1 | |
| SCHEMBL10370822 | 0.90 | BRS3 (0.51) | BRS3CYP2D6CYP2C9CYP2C19CYP2E1 | |
| SCHEMBL10370950 | 0.90 | BRS3 (0.51) | BRS3CYP2D6CYP2C9CYP2C19CYP2E1 | |
| SCHEMBL10373587 | 0.89 | BRS3 (0.50) | BRS3CYP2D6CYP2C9CYP2C19CYP2E1 | |
| SCHEMBL10373409 | 0.88 | BRS3 (0.49) | BRS3CYP2D6CYP2C9CYP2C19CYP2E1 | |
| SCHEMBL10371414 | 0.88 | BRS3 (0.49) | BRS3CYP2D6CYP2C9CYP2C19CYP2E1 | |
| SCHEMBL10371431 | 0.88 | CYP2D6 (0.52) | BRS3CYP2D6CYP2C9CYP2C19CYP2E1 | |
| SCHEMBL10370886 | 0.87 | CYP2C9 (0.49) | BRS3CYP2D6CYP2C9CYP2C19CYP2E1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0390842-A1 | NOVEL BENZIMIDAZOLE DERIVATIVES | Byk Gulden Lomberg Chemische Fabrik GmbH (DE) | 1990-10-10 | — | — | EP | disclosed |
| WO-1989005299-A1 | NOVEL BENZIMIDAZOLE DERIVATIVES | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1989-06-15 | — | — | WO | disclosed |