Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 9/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.37 |
| ▸ | CCR8 | P51685 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6017536 | 0.91 | HTR1A (0.36) | CHRM3ALDH1A1MEN1KMT2AMAPK1 | |
| SCHEMBL6017445 | 0.85 | CHRM2 (0.39) | CHRM3ALDH1A1MEN1KMT2AMAPK1 | |
| SCHEMBL6016864 | 0.81 | BCHE (0.37) | ALDH1A1HTR1ADRD2HTR7HTR6 | |
| SCHEMBL2639275 | 0.78 | CHRM2 (0.45) | CHRM3ALDH1A1MEN1KMT2AKCNH2 | |
| SCHEMBL6028157 | 0.77 | ACHE (0.39) | CHRM3ALDH1A1HTR1ADRD2HTR7 | |
| SCHEMBL6017518 | 0.77 | HTR1A (0.37) | CHRM3ALDH1A1MEN1KMT2AMAPK1 | |
| SCHEMBL1361966 | 0.75 | CHRM3 (0.65) | CHRM3SLC2A1 | |
| SCHEMBL4691377 | 0.74 | KMT2A (0.36) | ALDH1A1KMT2AHTR1ADRD2HTR7 | |
| SCHEMBL6021912 | 0.74 | CHRM2 (0.56) | ALDH1A1KDM4E | |
| SCHEMBL5247371 | 0.71 | HTR3A (0.44) | ALDH1A1MEN1KMT2AHTR1ADRD2 |
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-1723112-A1 | BIPHENYL COMPOUNDS USEFUL AS MUSCARINIC RECEPTOR ANTAGONISTS | Theravance, Inc. (US) | 2006-11-22 | — | — | EP | disclosed |
| WO-2005087736-A1 | BIPHENYL COMPOUNDS USEFUL AS MUSCARINIC RECEPTOR ANTAGONISTS | THERAVANCE, INC. (US) | 2005-09-22 | — | — | WO | disclosed |