Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.50 |
| ▸ | IDO1 | P14902 | 4/20 | 0.40 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NOS3 | P29474 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | CES1 | P23141 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | CTSL | P07711 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10655602 | 0.84 | CYP1A2 (0.48) | CYP1A2CYP3A4CYP2D6PRMT1IDO1 | |
| SCHEMBL2154643 | 0.83 | CYP1A2 (0.52) | CYP1A2CYP3A4CYP2D6PRMT1IDO1 | |
| SCHEMBL24191173 | 0.79 | CYP1A2 (0.48) | CYP1A2CYP3A4CYP2D6PRMT1IDO1 | |
| SCHEMBL24191057 | 0.77 | CYP1A2 (0.47) | CYP1A2CYP3A4CYP2D6PRMT1IDO1 | |
| SCHEMBL2059345 | 0.76 | CYP1A2 (0.46) | CYP1A2CYP3A4CYP2D6PRMT1IDO1 | |
| SCHEMBL9430438 | 0.74 | CYP1A2 (0.44) | CYP1A2CYP3A4CYP2D6PRMT1IDO1 | |
| SCHEMBL5680420 | 0.73 | CYP2D6 (0.63) | CYP1A2CYP3A4CYP2D6PRMT1IDO1 | |
| SCHEMBL6849329 | 0.73 | CYP1A2 (0.52) | CYP1A2CYP3A4CYP2D6PRMT1IDO1 | |
| Benzyl(Trityl)Sulfane SCHEMBL7543647 | 0.71 | KIF11 (0.54) | CYP1A2CYP3A4CYP2D6PRMT1CYP2C19 | |
| SCHEMBL22190423 | 0.71 | TAAR1 (0.45) | CYP1A2CYP3A4CYP2D6PRMT1IDO1 |
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-0052559-A2 | Bromopolyfluoralkylthioethers and process for their preparation | RHONE-POULENC SPECIALITES CHIMIQUES (FR) | 1982-05-26 | — | — | EP | disclosed |