Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 6/20 | 0.57 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.57 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | PLG | P00747 | 1/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.39 |
| ▸ | KLK1 | P06870 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Naphthalene SCHEMBL3285009 | 1.00 | CYP2A6 (0.57) | CYP2A6ALOX12CES2CES1CYP1A2 | |
| Naphthalene SCHEMBL3281278 | 0.94 | CYP2A6 (0.50) | CYP2A6ALOX12CES2CES1CYP1A2 | |
| Anthracene SCHEMBL3281461 | 0.87 | CES2 (0.44) | CYP2A6ALOX12CES2CES1CYP1A2 | |
| Benz(B)Anthracene SCHEMBL27925179 | 0.84 | ALDH1A1 (0.46) | CYP2A6ALOX12CES2CES1CYP1A2 | |
| Naphthalene SCHEMBL28221901 | 0.84 | CYP2A6 (0.47) | CYP2A6ALOX12CES2CES1CYP1A2 | |
| Phenanthrene SCHEMBL3811616 | 0.82 | ALDH1A1 (0.67) | CYP2A6CYP1A2ALDH1A1HSD17B10TDP1 | |
| Naphthalene SCHEMBL28112012 | 0.82 | CYP2A6 (0.44) | CYP2A6ALOX12CES2CES1CYP1A2 | |
| Naphthalene SCHEMBL28111529 | 0.82 | CYP2A6 (0.44) | CYP2A6ALOX12CES2CES1CYP1A2 | |
| Anthracene SCHEMBL3281536 | 0.82 | CES2 (0.41) | CYP2A6ALOX12CES2CES1CYP1A2 | |
| Naphthalene SCHEMBL11590930 | 0.80 | CYP2A6 (0.89) | CYP2A6ALOX12CYP1A2ALDH1A1HSD17B10 |
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-119528977-A | Stripping agent and stripping method for battery pole piece | 合肥综合性国家科学中心能源研究院(安徽省能源实验室) | 2025-02-28 | — | — | CN | disclosed |