Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 9/20 | 0.43 |
| ▸ | THRB | P10828 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10845394 | 0.88 | CYP3A4 (0.43) | CYP3A4THRBCYP2C9KDM4ECYP1A2 | |
| Alteconazole SCHEMBL30416434 | 0.87 | CYP3A4 (0.49) | CYP3A4THRBCYP2C9KDM4ECYP1A2 | |
| Alteconazole SCHEMBL9748291 | 0.87 | CYP3A4 (0.49) | CYP3A4THRBCYP2C9KDM4ECYP1A2 | |
| Alteconazole SCHEMBL2110163 | 0.87 | CYP3A4 (0.49) | CYP3A4THRBCYP2C9KDM4ECYP1A2 | |
| SCHEMBL9833161 | 0.82 | CYP3A4 (0.50) | CYP3A4THRBCYP2C9KDM4ECYP1A2 | |
| SCHEMBL10843665 | 0.80 | CYP3A4 (0.48) | CYP3A4THRBCYP2C9KDM4ECYP1A2 | |
| SCHEMBL10844736 | 0.80 | CYP3A4 (0.46) | CYP3A4THRBCYP2C9KDM4ECYP1A2 | |
| SCHEMBL10425812 | 0.78 | CYP3A4 (0.43) | CYP3A4THRBCYP2C9KDM4ECYP1A2 | |
| SCHEMBL3467654 | 0.77 | CYP3A4 (0.48) | CYP3A4THRBCYP2C9KDM4ECYP1A2 | |
| SCHEMBL2557411 | 0.77 | CYP3A4 (0.48) | CYP3A4THRBCYP2C9KDM4ECYP1A2 |
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-0133248-B1 | 1,2,4-TRIAZOL-1-YL-DERIVATIVES | SHIONOGI & CO., LTD. (JP) | 1991-11-21 | — | — | EP | claimed |
| US-4612322-A | FUNGICIDES | SHIONOGI & CO., LTD. (JP) | 1986-09-16 | — | — | US | claimed |
| EP-0133248-A2 | 1,2,4-Triazol-1-yl-derivatives | SHIONOGI & CO., LTD. (JP) | 1985-02-20 | — | — | EP | claimed |