Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UGT2B7 | P16662 | 1/20 | 0.46 |
| ▸ | KIF11 | P52732 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.42 |
| ▸ | NCEH1 | Q6PIU2 | 1/20 | 0.41 |
| ▸ | VDR | P11473 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10724286 | 0.93 | UGT2B7 (0.49) | UGT2B7KIF11AKR1B1NCEH1VDR | |
| Hydrogen Peroxide SCHEMBL8610415 | 0.84 | NCEH1 (0.47) | UGT2B7AKR1B1NCEH1MEN1KMT2A | |
| Hydrogen Peroxide SCHEMBL8609950 | 0.84 | NCEH1 (0.47) | UGT2B7AKR1B1NCEH1MEN1KMT2A | |
| SCHEMBL79572 | 0.81 | NCEH1 (0.46) | UGT2B7NCEH1MEN1KMT2ACYP1A2 | |
| Naphthalene SCHEMBL11043776 | 0.81 | NCEH1 (0.46) | UGT2B7NCEH1MEN1KMT2ACYP1A2 | |
| SCHEMBL9614446 | 0.79 | NCEH1 (0.45) | UGT2B7NCEH1MEN1KMT2ACYP1A2 | |
| SCHEMBL29781079 | 0.79 | NCEH1 (0.45) | UGT2B7NCEH1MEN1KMT2ACYP1A2 | |
| SCHEMBL10557357 | 0.79 | NCEH1 (0.45) | UGT2B7NCEH1MEN1KMT2ACYP1A2 | |
| SCHEMBL2020430 | 0.79 | NCEH1 (0.45) | UGT2B7NCEH1MEN1KMT2ACYP1A2 | |
| Ammonia Solution, Strong SCHEMBL27905097 | 0.79 | NCEH1 (0.45) | NCEH1MEN1KMT2ACYP1A2TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0239643-B1 | PROCESS FOR OXIDIZING 2,6-DIISOPROPYLNAPHTHALENE | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1991-08-21 | — | — | EP | claimed |