Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 3/20 | 0.77 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.77 |
| ▸ | LMNA | P02545 | 2/20 | 0.77 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.77 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.77 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.77 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.77 |
| ▸ | TSHR | P16473 | 2/20 | 0.77 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.77 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.77 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.77 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.77 |
| ▸ | ESR1 | P03372 | 2/20 | 0.77 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.77 |
| ▸ | PGR | P06401 | 2/20 | 0.77 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.77 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.77 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.77 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.77 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.77 |
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 | |
|---|---|---|---|---|
| SCHEMBL14340044 | 0.91 | CYP1A2 (0.85) | ALOX15ALDH1A1LMNACYP1A2CYP3A4 | |
| SCHEMBL11632185 | 0.88 | ALDH1A1 (0.60) | ALOX15ALDH1A1LMNACYP1A2CYP3A4 | |
| SCHEMBL11633431 | 0.87 | ALDH1A1 (0.83) | ALOX15ALDH1A1LMNACYP1A2CYP3A4 | |
| Butoconazole SCHEMBL44239 | 0.87 | CYP1A2 (1.00) | ALOX15ALDH1A1LMNACYP1A2CYP3A4 | |
| Butoconazole SCHEMBL44238 | 0.87 | CYP1A2 (1.00) | ALOX15ALDH1A1LMNACYP1A2CYP3A4 | |
| Butoconazole SCHEMBL44237 | 0.87 | CYP1A2 (1.00) | ALOX15ALDH1A1LMNACYP1A2CYP3A4 | |
| Butoconazole SCHEMBL29091982 | 0.86 | CYP1A2 (0.98) | ALOX15ALDH1A1LMNACYP1A2CYP3A4 | |
| SCHEMBL11633890 | 0.85 | ALDH1A1 (0.83) | ALOX15ALDH1A1LMNACYP1A2CYP3A4 | |
| SCHEMBL11442840 | 0.85 | ALDH1A1 (0.83) | ALOX15ALDH1A1LMNACYP1A2CYP3A4 | |
| SCHEMBL10829654 | 0.84 | CYP1A2 (0.67) | ALOX15ALDH1A1LMNACYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-4078071-A | FUNGICIDES, BACTERICIDES, ANTIPROTOZOA AGENTS | SYNTEX (U.S.A.) INC. (US) | 1978-03-07 | — | — | US | disclosed |