Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
| ▸ | PPARA | Q07869 | 8/20 | 0.43 |
| ▸ | PPARG | P37231 | 6/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8496952 | 0.95 | CYP3A4 (0.51) | CYP3A4MEN1KMT2AADORA3CHRM1 | |
| SCHEMBL11396758 | 0.87 | OPRK1 (0.47) | CYP3A4MEN1KMT2AADORA3CHRM1 | |
| SCHEMBL11393119 | 0.85 | PPARA (0.43) | CYP3A4MEN1KMT2AADORA3CHRM1 | |
| SCHEMBL11854999 | 0.83 | CYP3A4 (0.52) | CYP3A4MEN1KMT2AADORA3CHRM1 | |
| SCHEMBL11005515 | 0.82 | PPARA (0.48) | CYP3A4MEN1KMT2APPARAPPARG | |
| SCHEMBL11277557 | 0.82 | PPARA (0.53) | CYP3A4MEN1KMT2AADORA3CHRM1 | |
| SCHEMBL11274755 | 0.82 | PPARA (0.41) | CYP3A4MEN1KMT2AADORA3CHRM1 | |
| SCHEMBL10827183 | 0.81 | PPARA (0.58) | CYP3A4MEN1KMT2AADORA3SLC6A2 | |
| SCHEMBL11268638 | 0.81 | PPARA (0.50) | CYP3A4MEN1KMT2AADORA3CHRM1 | |
| SCHEMBL11003522 | 0.81 | PPARA (0.42) | CYP3A4MEN1KMT2AADORA3CHRM1 |
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-4151287-A | Combating fungi with 1-diaryloxy-1-triazolyl-3,3-dimethyl-butan-2-ones and butan-2-ols | BAYER AKTIENGESELLSCHAFT (DE) | 1979-04-24 | — | — | US | disclosed |