Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.38 |
| ▸ | DHFR | P00374 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.34 |
| ▸ | CYSLTR1 | Q9Y271 | 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 | |
|---|---|---|---|---|
| SCHEMBL9305655 | 0.72 | BRD4 (0.60) | PDE4APDE4BPDE4CPDE4DBRD4 | |
| Hydrochloric Acid SCHEMBL9304134 | 0.71 | BRD4 (0.58) | PDE4APDE4BPDE4CPDE4DBRD4 | |
| SCHEMBL9305716 | 0.69 | BRD4 (0.56) | BRD4PDK2CYSLTR2CYSLTR1 | |
| Hydrochloric Acid SCHEMBL9305103 | 0.68 | BRD4 (0.55) | BRD4PDK2CYSLTR2CYSLTR1 | |
| SCHEMBL9303733 | 0.68 | BRD4 (0.55) | BRD4PDK2 | |
| SCHEMBL3542730 | 0.68 | CYP4F2 (0.52) | BRD4 | |
| Hydrochloric Acid SCHEMBL9306210 | 0.68 | BRD4 (0.54) | BRD4PDK2 | |
| SCHEMBL9199191 | 0.67 | ACHE (0.47) | BRD4SMYD3TDP1 | |
| SCHEMBL3268399 | 0.67 | JAK2 (0.53) | DHFRCYP1A2L3MBTL1TDP1CYSLTR2 | |
| SCHEMBL9031704 | 0.67 | TSHR (0.49) | PDE4APDE4BPDE4CPDE4DBRD4 |
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-2022238507-A1 | THERAPEUTIC AMINOINDANE COMPOUNDS AND COMPOSITIONS | AWAKN LS EUROPE HOLDINGS LIMITED (IE) | 2022-11-17 | — | — | WO | disclosed |