Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UGT2B7 | P16662 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8097006 | 0.76 | TAAR1 (0.40) | SLC6A4CYP2D6MEN1KMT2AAOC3 | |
| SCHEMBL9179436 | 0.75 | UGT2B7 (0.71) | UGT2B7CYP2D6MEN1KMT2AAOC3 | |
| Naphthalene SCHEMBL29078859 | 0.75 | UGT2B7 (0.71) | UGT2B7CYP2D6MEN1KMT2AAOC3 | |
| SCHEMBL30928206 | 0.75 | UGT2B7 (0.71) | UGT2B7CYP2D6MEN1KMT2AAOC3 | |
| Naphthalene SCHEMBL9636781 | 0.75 | UGT2B7 (0.71) | UGT2B7CYP2D6MEN1KMT2AAOC3 | |
| SCHEMBL599956 | 0.75 | UGT2B7 (0.71) | UGT2B7CYP2D6MEN1KMT2AAOC3 | |
| SCHEMBL29555341 | 0.75 | UGT2B7 (0.71) | UGT2B7CYP2D6MEN1KMT2AAOC3 | |
| SCHEMBL6191864 | 0.74 | UGT2B7 (0.63) | UGT2B7SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL17892222 | 0.74 | UGT2B7 (0.63) | UGT2B7SLC6A2SLC6A4SLC6A3CYP2D6 | |
| SCHEMBL29817405 | 0.74 | UGT2B7 (0.63) | UGT2B7SLC6A2SLC6A4SLC6A3CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0399284-B1 | Method for the production of geminal diarylalkanes, geminal diarylalkanes and alk(en)ylated aromatic compounds | BAYER AG (DE) | 1995-08-02 | — | — | EP | disclosed |
| US-5136114-A | PROCESS FOR THE PREPARATION OF GEMINAL DIARYLALKANES, NEW GEMINAL DIARYLALKANES AND ALK(EN)YLATED AROMATIC COMPOUNDS | BAYER AKTIENGESELLSCHAFT (DE) | 1992-08-04 | — | — | US | disclosed |
| EP-0399284-A2 | Method for the production of geminal diarylalkanes, geminal diarylalkanes and alk(en)ylated aromatic compounds | BAYER AG (DE) | 1990-11-28 | — | — | EP | disclosed |