Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.42 |
| ▸ | CYP3A5 | P20815 | 4/20 | 0.42 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.39 |
| ▸ | SCN4A | P35499 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | KCND3 | Q9UK17 | 1/20 | 0.38 |
| ▸ | CFTR | P13569 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Chloromethane SCHEMBL10559562 | 0.85 | GAA (0.43) | CYP19A1GAAKCNA5ALDH1A1CFTR | |
| SCHEMBL10557447 | 0.85 | CYP19A1 (0.50) | CYP19A1CYP3A4CYP3A5KCNA5KCND3 | |
| SCHEMBL10557401 | 0.85 | GAA (0.45) | GAAALDH1A1CFTRSLC6A2SLC6A4 | |
| SCHEMBL10562484 | 0.82 | ALPL (0.45) | CYP19A1CYP3A4CYP3A5ALDH1A1SLC6A2 | |
| SCHEMBL14675425 | 0.81 | SCN4A (0.51) | CYP3A4SCN4ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL10560483 | 0.80 | GAA (0.66) | CYP19A1GAAKCNA5CFTRSLC6A2 | |
| Hydrochloric Acid SCHEMBL14676202 | 0.80 | SCN4A (0.50) | CYP3A4SCN4A | |
| SCHEMBL10559380 | 0.79 | CYP19A1 (0.41) | CYP19A1GAAALDH1A1CFTRSLC6A2 | |
| SCHEMBL14678017 | 0.77 | S1PR1 (0.47) | GAACYP3A4SCN4ASLC6A2SLC6A3 | |
| SCHEMBL3832267 | 0.76 | CYP19A1 (0.68) | CYP19A1CYP3A4CYP3A5CFTRSLC6A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4874775-A | INHIBIT PHYTOPATHOGENS | ELI LILLY AND COMPANY (US) | 1989-10-17 | — | — | US | disclosed |
| EP-0206581-A2 | Agriculturally-useful sulfonamides | ELI LILLY AND COMPANY (US) | 1986-12-30 | — | — | EP | disclosed |