Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.30 |
| ▸ | HTR3B | O95264 | 1/20 | 0.30 |
| ▸ | HTR3A | P46098 | 1/20 | 0.30 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.30 |
| ▸ | HTR3C | Q8WXA8 | 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 | |
|---|---|---|---|---|
| SCHEMBL550049 | 0.71 | CYP3A4 (0.39) | CYP3A4TSHRALDH1A1 | |
| SCHEMBL21801997 | 0.69 | NCF1 (0.43) | CYP3A4TSHRALDH1A1HTR3EHTR3B | |
| SCHEMBL14627577 | 0.68 | CYP3A4 (0.42) | CYP3A4TSHRALDH1A1HTR3EHTR3B | |
| SCHEMBL22617776 | 0.66 | TSHR (0.39) | CYP3A4TSHRALDH1A1HTR3EHTR3B | |
| SCHEMBL7974741 | 0.65 | ALDH1A1 (0.35) | CYP3A4TSHRALDH1A1HTR3EHTR3B | |
| SCHEMBL7969166 | 0.64 | CYP2A6 (0.34) | CYP3A4TSHR | |
| SCHEMBL28450086 | 0.63 | ALDH1A1 (0.44) | CYP3A4TSHRALDH1A1HTR3EHTR3B | |
| SCHEMBL16114069 | 0.63 | CNR1 (0.44) | CYP3A4TSHRALDH1A1HTR3EHTR3B | |
| SCHEMBL3417045 | 0.62 | ALDH1A1 (0.40) | CYP3A4TSHRALDH1A1 | |
| Nitrapyrin SCHEMBL41442 | 0.62 | CYP3A4 (1.00) | CYP3A4TSHRALDH1A1HTR3EHTR3B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001017965-A2 | CYANOPIPERIDINES AS PESTICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2001-03-15 | — | — | WO | disclosed |