Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.42 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MPI | P34949 | 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 | |
|---|---|---|---|---|
| SCHEMBL15701845 | 0.88 | MAOA (0.41) | CYP1A2CYP2A6DNMT1MAOAALDH1A1 | |
| SCHEMBL15701851 | 0.86 | GRM2 (0.47) | CYP1A2CYP2A6DNMT1ALDH1A1SMN1; SMN2 | |
| SCHEMBL12426756 | 0.84 | DNMT1 (0.46) | CYP1A2CYP2A6DNMT1ALDH1A1SMN1; SMN2 | |
| SCHEMBL27349327 | 0.83 | DNMT1 (0.45) | CYP1A2CYP2A6DNMT1ALDH1A1SMN1; SMN2 | |
| SCHEMBL9857430 | 0.83 | CYP1A2 (0.50) | CYP1A2CYP2A6DNMT1MAOAALDH1A1 | |
| SCHEMBL9856898 | 0.79 | ERN1 (0.47) | CYP1A2CYP2A6ALDH1A1SMN1; SMN2CYP2C9 | |
| SCHEMBL10062252 | 0.78 | TSHR (0.47) | CYP1A2CYP2A6DNMT1ALDH1A1CYP2C9 | |
| SCHEMBL9856903 | 0.78 | WDR5 (0.47) | CYP1A2CYP2A6DNMT1ALDH1A1HPGD | |
| SCHEMBL7170867 | 0.77 | CYP2A6 (0.44) | CYP1A2CYP2A6DNMT1MAOAALDH1A1 | |
| SCHEMBL7643518 | 0.77 | DNMT1 (0.48) | CYP1A2CYP2A6DNMT1ALDH1A1LMNA |
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-0426846-A1 | FLUORINATED-AROMATIC SULFONIC ACID CATALYST, PROCESS FOR ITS PRODUCTION, AND ITS USE | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1991-05-15 | — | — | EP | disclosed |