Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 5/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.39 |
| ▸ | CES1 | P23141 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | JAK1 | P23458 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
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 | 0.94 | CYP2A6 (0.57) | CYP2A6ALOX12CES2CES1CYP1A2 | |
| Naphthalene SCHEMBL31456246 | 0.94 | CYP2A6 (0.57) | CYP2A6ALOX12CES2CES1CYP1A2 | |
| Anthracene SCHEMBL3281536 | 0.88 | CES2 (0.41) | CYP2A6ALOX12CES2CES1CYP1A2 | |
| Naphthalene SCHEMBL8366099 | 0.83 | CYP2A6 (0.73) | CYP2A6ALOX12CES2CES1CYP1A2 | |
| Naphthalene SCHEMBL194159 | 0.83 | CYP2A6 (0.73) | CYP2A6ALOX12CES2CES1CYP1A2 | |
| Anthracene SCHEMBL3281461 | 0.81 | CES2 (0.44) | CYP2A6ALOX12CES2CES1CYP1A2 | |
| Naphthalene SCHEMBL28051541 | 0.80 | CYP2A6 (0.57) | CYP2A6ALOX12CES2CES1CYP1A2 | |
| Naphthalene SCHEMBL4409490 | 0.79 | CYP2A6 (0.67) | CYP2A6ALOX12CES2CES1CYP1A2 | |
| Naphthalene SCHEMBL28221901 | 0.79 | CYP2A6 (0.47) | CYP2A6ALOX12CES2CES1CYP1A2 | |
| Benz(B)Anthracene SCHEMBL27925179 | 0.79 | ALDH1A1 (0.46) | CYP2A6ALOX12CES2CES1CYP1A2 |
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-7704939-B2 | Surfactant | SANYO CHEMICAL INDUSTRIES, LTD. (JP) | 2010-04-27 | — | — | US | disclosed |
| US-20070167343-A1 | neutralized salt including alkylbenzenesulphonates (toluenesulfonic acid guanidine salt, toluenesulfonic acid DBU salt, toluenesulfonic acid DBN salt) for cleaning electonics | SANYO CHEMICAL INDUSTRIES, LTD. (JP) | 2007-07-19 | — | — | US | disclosed |