Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5247685 | 0.85 | OPRK1 (0.37) | CHRM1 | |
| SCHEMBL6027383 | 0.84 | OPRM1 (0.36) | KDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL6027738 | 0.83 | ESRRG (0.40) | GAASMN1; SMN2 | |
| SCHEMBL6027362 | 0.83 | TRPV1 (0.39) | ALDH1A1 | |
| SCHEMBL6028196 | 0.82 | ITGB1 (0.33) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL5722184 | 0.82 | CHRM5 (0.38) | SMN1; SMN2MEN1KMT2ACHRNB2CHRNB4 | |
| SCHEMBL4695511 | 0.81 | PDCD1 (0.34) | HTTSMN1; SMN2 | |
| SCHEMBL4695551 | 0.81 | CNR2 (0.40) | GAASMN1; SMN2KDM4EMEN1KMT2A | |
| SCHEMBL4691773 | 0.81 | KDM4E (0.41) | KDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL6022221 | 0.81 | BCHE (0.39) | L3MBTL1CHRM3 |
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-1866284-A1 | BIPHENYL COMPOUNDS USEFUL AS MUSCARINIC RECEPTOR ANTAGONISTS | Theravance, Inc. (US) | 2007-12-19 | — | — | EP | disclosed |
| WO-2006099167-A1 | BIPHENYL COMPOUNDS USEFUL AS MUSCARINIC RECEPTOR ANTAGONISTS | THERAVANCE, INC. (US) | 2006-09-21 | — | — | WO | disclosed |