Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | PREP | P48147 | 4/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.31 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4685375 | 0.87 | CHRM2 (0.36) | BTKCHRM2CHRM1CHRM3PREP | |
| SCHEMBL4685371 | 0.87 | CHRM2 (0.36) | BTKCHRM2CHRM1CHRM3PREP | |
| SCHEMBL16213867 | 0.82 | HRH3 (0.38) | BTKCHRM2CHRM1CHRM3PREP | |
| SCHEMBL14387419 | 0.79 | CHRM2 (0.34) | BTKCHRM2CHRM1CHRM3PREP | |
| SCHEMBL21159154 | 0.79 | ALDH1A1 (0.44) | BTKHRH3 | |
| SCHEMBL6121092 | 0.79 | ALDH1A1 (0.44) | BTKHRH3 | |
| SCHEMBL15541647 | 0.78 | BTK (0.36) | BTKCHRM2CHRM1CHRM3GRM2 | |
| SCHEMBL12968568 | 0.78 | CHRM2 (0.40) | BTKCHRM2CHRM1CHRM3PREP | |
| SCHEMBL6926352 | 0.78 | CHRM2 (0.40) | BTKCHRM2CHRM1CHRM3PREP | |
| SCHEMBL15369037 | 0.77 | BTK (0.41) | BTKCHRM2CHRM1CHRM3GRM2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1981847-A1 | SECONDARY AMINES AS RENIN INHIBITORS | Actelion Pharmaceuticals Ltd. (CH) | 2008-10-22 | — | — | EP | disclosed |
| WO-2007088514-A1 | SECONDARY AMINES AS RENIN INHIBITORS | ACTELION PHARMACEUTICALS LTD (CH) | 2007-08-09 | — | — | WO | disclosed |