Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 8/20 | 0.65 |
| ▸ | ACHE | P22303 | 8/20 | 0.65 |
| ▸ | BCHE | P06276 | 6/20 | 0.65 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | TYR | P14679 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL25694159 | 0.83 | ACHE (0.63) | PTGS2ACHEBCHENPC1RAB9A | |
| SCHEMBL6394314 | 0.81 | PTGS2 (0.57) | PTGS2ACHEBCHENPC1RAB9A | |
| SCHEMBL13583200 | 0.80 | PTGS2 (0.64) | PTGS2ACHEBCHENPC1RAB9A | |
| SCHEMBL13583204 | 0.80 | PTGS2 (0.64) | PTGS2ACHEBCHENPC1RAB9A | |
| SCHEMBL15145397 | 0.78 | PTGS2 (0.57) | PTGS2ACHEBCHENPC1RAB9A | |
| SCHEMBL895976 | 0.78 | PTGS2 (0.62) | PTGS2ACHEBCHENPC1RAB9A | |
| SCHEMBL2232059 | 0.78 | ACHE (0.79) | PTGS2ACHEBCHENPC1RAB9A | |
| SCHEMBL2232062 | 0.78 | ACHE (0.79) | PTGS2ACHEBCHENPC1RAB9A | |
| SCHEMBL28952511 | 0.76 | PTGS2 (0.54) | PTGS2ACHEBCHENPC1RAB9A | |
| SCHEMBL28053389 | 0.76 | PTGS2 (0.58) | PTGS2ACHEBCHENPC1RAB9A |
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-2928889-B1 | COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY | CHIESI FARM SPA (IT) | 2018-03-21 | — | — | EP | disclosed |