Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | SYK | P43405 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.37 |
| ▸ | TRPM5 | Q9NZQ8 | 1/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CLK1 | P49759 | 2/20 | 0.33 |
| ▸ | CLK2 | P49760 | 2/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.33 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.33 |
| ▸ | CLK3 | P49761 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
| ▸ | AKT2 | P31751 | 1/20 | 0.33 |
| ▸ | PDE1A | P54750 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22828091 | 0.82 | PTGS2 (0.57) | SYKPTGS2 | |
| SCHEMBL22828098 | 0.81 | PTGS2 (0.53) | ADORA3PTGS2TRPM5HRH4KDM4E | |
| SCHEMBL22828107 | 0.81 | ALDH1A1 (0.54) | ADORA3ADORA2AADORA2BADORA1PTGS2 | |
| SCHEMBL22827975 | 0.77 | TP53 (0.48) | ADORA3ADORA2AADORA2BADORA1PTGS2 | |
| SCHEMBL22828088 | 0.70 | PTGS2 (0.53) | ADORA3PTGS2TRPM5LMNAALDH1A1 | |
| SCHEMBL24334957 | 0.69 | PTGS2 (0.59) | PTGS2 | |
| SCHEMBL3451616 | 0.68 | MEN1 (0.46) | ADORA3ADORA2AADORA2BADORA1SYK | |
| SCHEMBL3452020 | 0.67 | HSP90AA1 (0.64) | ADORA3ADORA2AADORA2BADORA1HRH4 | |
| SCHEMBL22827979 | 0.65 | KDM4E (0.54) | ADORA3ADORA2AADORA2BADORA1PTGS2 | |
| SCHEMBL22828097 | 0.64 | PTGS2 (0.76) | PTGS2 |
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-2020257653-A1 | RADIOLABELED COMPOUNDS AND USES THEREOF | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2020-12-24 | — | — | WO | disclosed |