Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.48 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.48 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.48 |
| ▸ | ASIC3 | Q9UHC3 | 2/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 6/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | ACACB | O00763 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 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 | |
|---|---|---|---|---|
| SCHEMBL5573799 | 0.90 | ASIC3 (0.53) | CYP1A2CYP1A1CYP1B1ASIC3CYP2A6 | |
| SCHEMBL9626458 | 0.87 | CYP1A2 (0.43) | CYP1A2CYP1A1CYP1B1ASIC3CYP2A6 | |
| SCHEMBL10705668 | 0.83 | ASIC3 (0.63) | CYP1A2CYP1A1CYP1B1ASIC3CYP2A6 | |
| SCHEMBL30447338 | 0.83 | ASIC3 (0.63) | CYP1A2CYP1A1CYP1B1ASIC3CYP2A6 | |
| SCHEMBL5572006 | 0.82 | ASIC3 (0.52) | CYP1A2CYP1A1CYP1B1ASIC3CYP2A6 | |
| SCHEMBL5573818 | 0.82 | ASIC3 (0.52) | CYP1A2CYP1A1CYP1B1ASIC3CYP2A6 | |
| SCHEMBL23883181 | 0.81 | CYP1A2 (0.50) | CYP1A2CYP1A1CYP1B1ASIC3CYP2A6 | |
| SCHEMBL31612321 | 0.81 | CYP1A2 (0.50) | CYP1A2CYP1A1CYP1B1ASIC3CYP2A6 | |
| SCHEMBL28488853 | 0.81 | CYP1A2 (0.46) | CYP1A2CYP1A1CYP1B1ASIC3CYP2A6 | |
| SCHEMBL12462976 | 0.81 | CYP1A2 (0.46) | CYP1A2CYP1A1CYP1B1ASIC3CYP2A6 |
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-6350875-B1 | COMPOUNDS FOR ELECTRONICS | THE UNIVERSITY OF SOUTHERN CALIFORNIA | 2002-02-26 | — | — | US | claimed |