Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 12/20 | 0.48 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.48 |
| ▸ | DRD2 | P14416 | 3/20 | 0.42 |
| ▸ | DRD4 | P21917 | 3/20 | 0.42 |
| ▸ | DRD3 | P35462 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL18791026 | 0.88 | GAA (0.53) | CYP11B2CYP11B1DRD2DRD4DRD3 | |
| SCHEMBL18791093 | 0.85 | CYP11B2 (0.66) | CYP11B2CYP11B1 | |
| SCHEMBL20513563 | 0.78 | CYP11B2 (0.71) | CYP11B2CYP11B1 | |
| SCHEMBL20513565 | 0.78 | CYP11B2 (0.71) | CYP11B2CYP11B1 | |
| SCHEMBL18790704 | 0.78 | SLC6A9 (0.47) | CYP11B2CYP11B1DRD2DRD4 | |
| SCHEMBL18790973 | 0.76 | CYP11B2 (0.43) | CYP11B2CYP11B1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL18791088 | 0.76 | CKS1B (0.49) | — | |
| SCHEMBL22236793 | 0.75 | CYP11B2 (0.44) | CYP11B2CYP11B1 | |
| SCHEMBL18791032 | 0.75 | CYP11B2 (0.48) | CYP11B2CYP11B1 | |
| SCHEMBL18790971 | 0.74 | CYP11B2 (0.44) | CYP11B2CYP11B1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017069226-A1 | NOVEL NITROGEN-CONTAINING AROMATIC HETEROCYCLIC COMPOUND | 田辺三菱製薬株式会社 | 2017-04-27 | — | — | WO | disclosed |