Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL10852241 | 0.81 | SLC6A2 (0.41) | ALDH1A1 | |
| SCHEMBL9367962 | 0.81 | KDM4E (0.37) | TAAR1KDM4EALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL3900675 | 0.79 | TAAR1 (0.35) | TAAR1 | |
| SCHEMBL3995603 | 0.77 | TAAR1 (0.43) | TAAR1ALDH1A1 | |
| SCHEMBL17746142 | 0.71 | TAAR1 (0.39) | TAAR1KDM4EALDH1A1CYP1A2 | |
| SCHEMBL11239184 | 0.70 | CHRNA1 (0.35) | — | |
| SCHEMBL14142801 | 0.70 | TAAR1 (0.47) | TAAR1ALDH1A1 | |
| SCHEMBL3209284 | 0.70 | TAAR1 (0.47) | TAAR1ALDH1A1 | |
| SCHEMBL11243351 | 0.69 | CHRNA1 (0.35) | ALDH1A1 | |
| SCHEMBL3891785 | 0.68 | MAOB (0.38) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113234066-A | Propiconazole-like compound and preparation method and application thereof | 浙江工业大学 | 2021-08-10 | — | — | CN | disclosed |