Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 3/20 | 0.42 |
| ▸ | PPARD | Q03181 | 3/20 | 0.42 |
| ▸ | PPARA | Q07869 | 3/20 | 0.42 |
| ▸ | HTR6 | P50406 | 10/20 | 0.41 |
| ▸ | EEF2K | O00418 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | HTR7 | P34969 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 1/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | SLC1A3 | P43003 | 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 | |
|---|---|---|---|---|
| SCHEMBL3362896 | 0.91 | HTR6 (0.44) | PPARGPPARDPPARAHTR6CYP3A4 | |
| SCHEMBL3367219 | 0.90 | MEN1 (0.45) | PPARGHTR6CYP3A4CYP2D6DRD2 | |
| SCHEMBL3146040 | 0.83 | AKR1C3 (0.51) | PPARGPPARDPPARAHTR6EEF2K | |
| SCHEMBL3362365 | 0.81 | HTR6 (0.42) | HTR6CYP3A4CYP2D6DRD2SLC6A2 | |
| SCHEMBL3366631 | 0.79 | FLT1 (0.43) | HTR6CYP3A4CYP2D6DRD2SLC6A2 | |
| SCHEMBL3363097 | 0.77 | HTR6 (0.42) | HTR6CYP3A4CYP2D6DRD2SLC6A2 | |
| SCHEMBL27713331 | 0.76 | HTR6 (0.48) | HTR6 | |
| SCHEMBL27641191 | 0.75 | HTR6 (0.53) | HTR6CYP3A4CYP2D6DRD2SLC6A2 | |
| SCHEMBL27713327 | 0.74 | MEN1 (0.43) | PPARGPPARDPPARAHTR6DRD2 | |
| SCHEMBL27641195 | 0.73 | HTR6 (0.51) | HTR6CYP3A4CYP2D6DRD2SLC6A2 |
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-2118060-B1 | 1-BENZENESULFONYL-1H-INDOLE DERIVATIVES AS INHIBITORS OF CCR9 ACTIVITY | NOVARTIS AG (CH) | 2010-10-06 | — | — | EP | claimed |