Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATP1A1 | P05023 | 2/20 | 0.30 |
| ▸ | ATP1B1 | P05026 | 2/20 | 0.30 |
| ▸ | ATP1A3 | P13637 | 2/20 | 0.30 |
| ▸ | ATP1B2 | P14415 | 2/20 | 0.30 |
| ▸ | ATP4A | P20648 | 2/20 | 0.30 |
| ▸ | ATP1A2 | P50993 | 2/20 | 0.30 |
| ▸ | ATP4B | P51164 | 2/20 | 0.30 |
| ▸ | ATP1B3 | P54709 | 2/20 | 0.30 |
| ▸ | FXYD2 | P54710 | 2/20 | 0.30 |
| ▸ | ATP1A4 | Q13733 | 2/20 | 0.30 |
| ▸ | DRD1 | P21728 | 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 | |
|---|---|---|---|---|
| SCHEMBL9688025 | 0.86 | ATP4A (0.43) | ATP1A1ATP1B1ATP1A3ATP1B2ATP4A | |
| SCHEMBL9686836 | 0.85 | ATP4A (0.43) | ATP1A1ATP1B1ATP1A3ATP1B2ATP4A | |
| SCHEMBL10752617 | 0.85 | ATP4A (0.43) | ATP1A1ATP1B1ATP1A3ATP1B2ATP4A | |
| SCHEMBL9688061 | 0.83 | — | — | |
| SCHEMBL9688510 | 0.83 | WDR5 (0.41) | ATP1A1ATP1B1ATP1A3ATP1B2ATP4A | |
| SCHEMBL9688809 | 0.82 | ATP4A (0.34) | ATP1A1ATP1B1ATP1A3ATP1B2ATP4A | |
| SCHEMBL9688518 | 0.82 | ATP4A (0.43) | ATP1A1ATP1B1ATP1A3ATP1B2ATP4A | |
| SCHEMBL9687927 | 0.81 | ATP4A (0.41) | ATP1A1ATP1B1ATP1A3ATP1B2ATP4A | |
| SCHEMBL9686873 | 0.80 | — | — | |
| SCHEMBL9531500 | 0.80 | ATP4A (0.44) | ATP1A1ATP1B1ATP1A3ATP1B2ATP4A |
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-0201575-B1 | NEW PICOLINE DERIVATIVES, PREPARATION PROCESS THEREOF, UTILIZATION THEREOF AND DRUGS CONTAINING THEM | Byk Gulden Lomberg Chemische Fabrik GmbH (DE) | 1992-08-12 | — | — | EP | disclosed |
| US-4686230-A | Picoline derivative useful as gastric acid secretion inhibitors | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1987-08-11 | — | — | US | disclosed |