Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 15/20 | 0.36 |
| ▸ | HTR7 | P34969 | 13/20 | 0.36 |
| ▸ | DRD2 | P14416 | 13/20 | 0.36 |
| ▸ | HTR6 | P50406 | 10/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR5A | P47898 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6021982 | 0.86 | ALDH1A1 (0.39) | TRPV1ALDH1A1GAAHDAC1 | |
| SCHEMBL5805321 | 0.85 | HDAC3 (0.40) | HTR1AHTR7DRD2HTR6TRPV1 | |
| SCHEMBL6027475 | 0.84 | TRPV1 (0.37) | HTR1AHTR7DRD2HTR6TRPV1 | |
| SCHEMBL6022221 | 0.84 | BCHE (0.39) | HTR1AHTR7DRD2HTR6TRPV1 | |
| SCHEMBL6021999 | 0.83 | LTB4R2 (0.33) | HTR1AHTR7DRD2HTR6TRPV1 | |
| SCHEMBL6021934 | 0.81 | MEN1 (0.40) | TRPV1ALDH1A1GAAHDAC1 | |
| SCHEMBL6021946 | 0.80 | TRPV1 (0.47) | TRPV1ALDH1A1 | |
| SCHEMBL4691401 | 0.79 | HTR1A (0.41) | HTR1AHTR7DRD2HTR6ALDH1A1 | |
| SCHEMBL6021284 | 0.79 | LTB4R2 (0.37) | ALDH1A1 | |
| SCHEMBL5280978 | 0.79 | CD274 (0.34) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1723110-A1 | BIPHENYL COMPOUNDS USEFUL AS MUSCARINIC RECEPTOR ANTAGONISTS | Theravance, Inc. (US) | 2006-11-22 | — | — | EP | claimed |
| WO-2005087735-A1 | BIPHENYL COMPOUNDS USEFUL AS MUSCARINIC RECEPTOR ANTAGONISTS | THERAVANCE, INC. (US) | 2005-09-22 | — | — | WO | claimed |
| EP-1723110-A1 | BIPHENYL COMPOUNDS USEFUL AS MUSCARINIC RECEPTOR ANTAGONISTS | Theravance, Inc. (US) | 2006-11-22 | — | — | EP | disclosed |
| WO-2005087735-A1 | BIPHENYL COMPOUNDS USEFUL AS MUSCARINIC RECEPTOR ANTAGONISTS | THERAVANCE, INC. (US) | 2005-09-22 | — | — | WO | disclosed |