Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATP4A | P20648 | 4/20 | 0.47 |
| ▸ | ATP4B | P51164 | 4/20 | 0.47 |
| ▸ | CYP2E1 | P05181 | 9/20 | 0.47 |
| ▸ | CYP2C8 | P10632 | 9/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 9/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 9/20 | 0.47 |
| ▸ | CYP2B6 | P20813 | 9/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 9/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.47 |
| ▸ | NOS2 | P35228 | 2/20 | 0.44 |
| ▸ | NOS3 | P29474 | 1/20 | 0.44 |
| ▸ | NOS1 | P29475 | 1/20 | 0.44 |
| ▸ | ATP1A1 | P05023 | 2/20 | 0.43 |
| ▸ | ATP1B1 | P05026 | 2/20 | 0.43 |
| ▸ | ATP1A3 | P13637 | 2/20 | 0.43 |
| ▸ | ATP1B2 | P14415 | 2/20 | 0.43 |
| ▸ | ATP1A2 | P50993 | 2/20 | 0.43 |
| ▸ | ATP1B3 | P54709 | 2/20 | 0.43 |
| ▸ | FXYD2 | P54710 | 2/20 | 0.43 |
| ▸ | ATP1A4 | Q13733 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10370999 | 0.97 | ATP4A (0.47) | ATP4AATP4BCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL10370991 | 0.91 | CYP2E1 (0.48) | ATP4AATP4BCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL6881681 | 0.91 | ATP4A (0.56) | ATP4AATP4BCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL10370946 | 0.89 | CYP2E1 (0.49) | ATP4AATP4BCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL10370872 | 0.88 | CYP2D6 (0.49) | ATP4AATP4BCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL10371923 | 0.88 | CYP2E1 (0.48) | ATP4AATP4BCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL10372853 | 0.87 | CYP2E1 (0.52) | ATP4AATP4BCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL10372557 | 0.86 | ATP4A (0.49) | ATP4AATP4BCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL10370611 | 0.85 | ATP4A (0.49) | ATP4AATP4BCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL9526788 | 0.85 | ATP4A (0.57) | ATP4AATP4BCYP2E1CYP2C8CYP2D6 |
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 |