Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22365614 | 0.81 | MEN1 (0.47) | ALDH1A1HPGDMEN1KMT2AHTT | |
| SCHEMBL23018133 | 0.81 | HPGD (0.38) | ALDH1A1HPGDMEN1KMT2AKDM4E | |
| SCHEMBL16067425 | 0.77 | RAPGEF4 (0.43) | ALDH1A1HPGDMEN1HSP90AA1KMT2A | |
| SCHEMBL14850897 | 0.75 | RAPGEF4 (0.43) | ALDH1A1MEN1KMT2AKDM4EGAA | |
| SCHEMBL22877008 | 0.75 | GAA (0.31) | HPGDGAA | |
| SCHEMBL23616124 | 0.74 | CLCN2 (0.44) | ALDH1A1HPGDMEN1KMT2AGAA | |
| SCHEMBL23018159 | 0.71 | — | — | |
| SCHEMBL22678927 | 0.71 | TAS1R3 (0.42) | HPGDMEN1KMT2A | |
| SCHEMBL22383441 | 0.70 | GAA (0.45) | ALDH1A1HPGDMEN1KMT2AKDM4E | |
| SCHEMBL22877223 | 0.69 | KDM4E (0.55) | ALDH1A1HPGDMEN1KMT2AKDM4E |
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-3107898-B1 | 1,2-SUBSTITUTED CYCLOPENTANES AS OREXIN RECEPTOR ANTAGONISTS | TAKEDA PHARMACEUTICALS CO (JP) | 2021-01-06 | — | — | EP | disclosed |