Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 8/20 | 0.42 |
| ▸ | MAOB | P27338 | 8/20 | 0.42 |
| ▸ | AR | P10275 | 3/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.33 |
| ▸ | XDH | P47989 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8779794 | 0.76 | MAPT (0.47) | KDM4EMAPTHPGDCYP1A2CYP3A4 | |
| SCHEMBL27557345 | 0.67 | MAOB (0.48) | KDM4EMAPTHPGDCYP1A2CYP3A4 | |
| SCHEMBL8779795 | 0.66 | CYP2C9 (0.37) | CYP2C19CYP2C9 | |
| SCHEMBL6939635 | 0.66 | CYP1A2 (0.48) | MAPTHPGDCYP1A2CYP3A4CYP2C19 | |
| SCHEMBL8779790 | 0.64 | KDM4E (0.41) | KDM4EMAPTHPGDCYP1A2CYP3A4 | |
| SCHEMBL8779780 | 0.64 | NR1H2 (0.41) | HPGDCYP3A4CYP2C19MEN1KMT2A | |
| SCHEMBL13907659 | 0.63 | MAOB (0.80) | MAOAMAOBARMCL1 | |
| SCHEMBL10622196 | 0.62 | CYP1A2 (0.49) | KDM4EMAPTHPGDCYP1A2CYP3A4 | |
| SCHEMBL29337065 | 0.62 | MAOB (0.62) | KDM4EMAPTHPGDCYP1A2CYP3A4 | |
| SCHEMBL8489011 | 0.62 | MAOB (0.44) | ALDH1A1MAOAMAOB |
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-0770599-A1 | PROCESS FOR THE PREPARATION OF AROMATIC OR HETEROAROMATIC SULFONYL HALIDES | SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) | 1997-05-02 | — | — | EP | disclosed |