Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 2/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.42 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.37 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11045416 | 0.87 | CYP11B1 (0.43) | CYP11B1CYP11B2CYP2B6TBXAS1ALDH1A1 | |
| SCHEMBL10780763 | 0.86 | TBXAS1 (0.40) | CYP11B1CYP11B2CYP2B6TBXAS1ALDH1A1 | |
| SCHEMBL10785122 | 0.84 | TBXAS1 (0.46) | CYP11B1CYP11B2CYP2B6TBXAS1 | |
| SCHEMBL10782494 | 0.84 | TBXAS1 (0.46) | CYP11B1CYP11B2CYP2B6TBXAS1 | |
| SCHEMBL10779868 | 0.84 | TBXAS1 (0.46) | CYP11B1CYP11B2CYP2B6TBXAS1 | |
| SCHEMBL10782707 | 0.84 | CYP11B1 (0.43) | CYP11B1CYP11B2CYP2B6TBXAS1ALDH1A1 | |
| SCHEMBL10782742 | 0.83 | TBXAS1 (0.44) | TBXAS1KDM4E | |
| SCHEMBL10785527 | 0.83 | CYP11B1 (0.40) | CYP11B1CYP11B2CYP2B6TBXAS1ALDH1A1 | |
| SCHEMBL10782717 | 0.83 | CYP11B1 (0.44) | CYP11B1CYP11B2CYP2B6TBXAS1ALDH1A1 | |
| SCHEMBL10780709 | 0.82 | CYP11B1 (0.42) | CYP11B1CYP11B2CYP2B6TBXAS1 |
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-0111384-B1 | THIOKETAL SUBSTITUTED N-ALKYL IMIDAZOLES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SYNTEX (U.S.A.) INC. (US) | 1987-04-22 | — | — | EP | disclosed |
| US-4489087-A | Spermicidal thioketal substituted N-alkyl imidazoles | SYNTEX (U.S.A.) INC. (US) | 1984-12-18 | — | — | US | disclosed |
| EP-0111384-A1 | Thioketal substituted N-alkyl imidazoles and pharmaceutical compositions containing them | SYNTEX (U.S.A.) INC. (US) | 1984-06-20 | — | — | EP | disclosed |