Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | CA1 | P00915 | 15/20 | 0.38 |
| ▸ | CA2 | P00918 | 15/20 | 0.38 |
| ▸ | MPO | P05164 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 12/20 | 0.35 |
| ▸ | CA9 | Q16790 | 11/20 | 0.35 |
| ▸ | CA4 | P22748 | 7/20 | 0.33 |
| ▸ | ADRB2 | P07550 | 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 | |
|---|---|---|---|---|
| SCHEMBL22839931 | 0.82 | XDH (0.35) | — | |
| SCHEMBL23223716 | 0.80 | LMNA (0.40) | CA1CA2CA12CA9ADRB2 | |
| SCHEMBL21517317 | 0.78 | SLC5A1 (0.41) | CA1CA2ADRB2 | |
| SCHEMBL19903846 | 0.67 | ADRB2 (0.36) | ADRB2 | |
| SCHEMBL23223975 | 0.67 | KMT2A (0.47) | HTR2ACA1CA2CA12CA9 | |
| SCHEMBL16682342 | 0.64 | GAA (0.59) | HTR2ACA1CA2CA12CA9 | |
| SCHEMBL11935941 | 0.62 | CA1 (0.77) | CA1CA2CA12CA9CA4 | |
| SCHEMBL23223709 | 0.61 | ADRB2 (0.39) | ADRB2 | |
| SCHEMBL11695786 | 0.59 | CYP2D6 (0.56) | HTR2ACA1CA2MPOCA12 | |
| SCHEMBL3120826 | 0.59 | HRH4 (0.52) | HTR2ACA1CA2CA12CA9 |
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-3383867-B1 | COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY | CHIESI FARM SPA (IT) | 2021-04-14 | — | — | EP | disclosed |