Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS2 | P35228 | 13/20 | 0.42 |
| ▸ | NOS1 | P29475 | 11/20 | 0.42 |
| ▸ | NOS3 | P29474 | 8/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CBFB | Q13951 | 1/20 | 0.35 |
| ▸ | ATP4A | P20648 | 3/20 | 0.34 |
| ▸ | ATP4B | P51164 | 3/20 | 0.34 |
| ▸ | ATP1A1 | P05023 | 2/20 | 0.34 |
| ▸ | ATP1B1 | P05026 | 2/20 | 0.34 |
| ▸ | ATP1A3 | P13637 | 2/20 | 0.34 |
| ▸ | ATP1B2 | P14415 | 2/20 | 0.34 |
| ▸ | ATP1A2 | P50993 | 2/20 | 0.34 |
| ▸ | ATP1B3 | P54709 | 2/20 | 0.34 |
| ▸ | FXYD2 | P54710 | 2/20 | 0.34 |
| ▸ | ATP1A4 | Q13733 | 2/20 | 0.34 |
| ▸ | CCR1 | P32246 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 1/20 | 0.33 |
| ▸ | CCR8 | P51685 | 1/20 | 0.33 |
| ▸ | PDE8A | O60658 | 1/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9687860 | 0.86 | ATP4A (0.42) | NOS2NOS1NOS3CYP2C9ATP4A | |
| SCHEMBL10617562 | 0.83 | NOS2 (0.45) | NOS2NOS1NOS3CYP2C9CBFB | |
| SCHEMBL6442937 | 0.82 | CYP3A4 (0.40) | CYP2C9CBFB | |
| SCHEMBL9687927 | 0.81 | ATP4A (0.41) | NOS2NOS1NOS3CYP2C9ATP4A | |
| SCHEMBL6486433 | 0.80 | NOS2 (0.46) | NOS2NOS1NOS3CYP2C9ATP4A | |
| SCHEMBL9673068 | 0.80 | NOS2 (0.42) | NOS2NOS1NOS3CYP2C9CBFB | |
| SCHEMBL5663053 | 0.78 | NOS2 (0.44) | NOS2NOS1NOS3CYP2C9ATP4A | |
| SCHEMBL8571813 | 0.78 | NOS2 (0.41) | NOS2NOS1NOS3CYP2C9CBFB | |
| SCHEMBL11005411 | 0.77 | ATP4A (0.46) | NOS2NOS1NOS3CYP2C9CBFB | |
| SCHEMBL9686863 | 0.77 | ATP4A (0.41) | NOS2NOS1NOS3CYP2C9ATP4A |
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-0045200-B1 | BENZIMIDAZOLES AND THEIR PHARMACEUTICAL USE | THE UPJOHN COMPANY (US) | 1988-03-02 | — | — | EP | claimed |
| EP-0005129-B1 | SUBSTITUTED PYRIDYLSULFINYLBENZIMIDAZOLES HAVING GASTRIC ACID SECRETION PROPERTIES, PHARMACEUTICAL PREPARATIONS CONTAINING SAME, AND INTERMEDIATES FOR THEIR PREPARATION | Aktiebolaget Hässle (SE) | 1981-04-29 | — | — | EP | claimed |
| EP-0045200-B1 | BENZIMIDAZOLES AND THEIR PHARMACEUTICAL USE | THE UPJOHN COMPANY (US) | 1988-03-02 | — | — | EP | disclosed |