Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30802795 | 0.89 | HRH3 (0.42) | HRH3CYP1A2CYP2D6TSHRSLC6A2 | |
| SCHEMBL3138137 | 0.85 | HRH3 (0.41) | HRH3CYP1A2CYP2D6TSHRSLC6A2 | |
| SCHEMBL29964267 | 0.78 | HRH3 (0.40) | HRH3BRD4SLC6A2SLC6A4 | |
| SCHEMBL31127688 | 0.76 | IGF1R (0.37) | — | |
| SCHEMBL30206343 | 0.74 | MCHR1 (0.37) | HRH3 | |
| SCHEMBL22666884 | 0.74 | ACACB (0.44) | KDM4E | |
| SCHEMBL3544709 | 0.73 | HRH3 (0.50) | HRH3CYP2D6KDM4ESLC6A2SLC6A4 | |
| SCHEMBL16503327 | 0.72 | HRH3 (0.38) | HRH3SLC6A2SLC6A4 | |
| SCHEMBL16427236 | 0.72 | AKR1C3 (0.39) | HRH3SLC6A2SLC6A4 | |
| SCHEMBL29148153 | 0.72 | IGF1R (0.38) | HRH3BRD4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018071447-A1 | SUBSTITUTED PYRAZOLO[1,5-A]PYRIDINE COMPOUNDS AS RET KINASE INHIBITORS | ANDREWS STEVEN W (US) | 2018-04-19 | — | — | WO | disclosed |