Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 12/20 | 0.50 |
| ▸ | CHRM3 | P20309 | 12/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1975664 | 0.87 | SLC6A2 (0.60) | SLC6A2SLC6A4SLC6A3ALDH1A1SIGMAR1 | |
| SCHEMBL13115964 | 0.80 | TSHR (0.56) | CHRM2CHRM3SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL2141459 | 0.76 | SLC6A2 (0.52) | SLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL1246679 | 0.75 | SLC6A2 (0.42) | SLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL17318884 | 0.74 | LMNA (0.59) | CHRM2SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL2142306 | 0.73 | SLC6A2 (0.43) | SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL25787415 | 0.72 | TSHR (0.45) | SLC6A2SLC6A4SLC6A3KDM4E | |
| SCHEMBL17611714 | 0.72 | CYP2D6 (0.49) | CHRM2SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL20455758 | 0.71 | CYP2D6 (0.64) | ALDH1A1 | |
| SCHEMBL208118 | 0.71 | SIGMAR1 (0.68) | CHRM2KDM4EALDH1A1SIGMAR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010067102-A1 | DIAZASPIRO [5.5] UNDECANE DERIVATIVES AND RELATED COMPOUNDS AS MUSCARINIC-RECEPTOR ANTAGONISTS AND BETA-ADRENORECEPTOR AGONISTS FOR THE TREATMENT OF PULMONARY DISORDERS | ASTRAZENECA AB (SE) | 2010-06-17 | — | — | WO | disclosed |
| WO-2010067102-A1 | DIAZASPIRO [5.5] UNDECANE DERIVATIVES AND RELATED COMPOUNDS AS MUSCARINIC-RECEPTOR ANTAGONISTS AND BETA-ADRENORECEPTOR AGONISTS FOR THE TREATMENT OF PULMONARY DISORDERS | ASTRAZENECA AB (SE) | 2010-06-17 | — | — | WO | disclosed |