Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 9/20 | 0.44 |
| ▸ | CHRNA4 | P43681 | 9/20 | 0.44 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 3/20 | 0.40 |
| ▸ | CHRNA1 | P02708 | 2/20 | 0.40 |
| ▸ | CHRNB1 | P11230 | 2/20 | 0.40 |
| ▸ | CHRNG | P07510 | 1/20 | 0.40 |
| ▸ | CHRND | Q07001 | 1/20 | 0.40 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4320521 | 1.00 | CHRNB2 (0.44) | CHRNB2CHRNA4CHRNA3CHRNB4CYP3A4 | |
| SCHEMBL4320526 | 1.00 | CHRNB2 (0.44) | CHRNB2CHRNA4CHRNA3CHRNB4CYP3A4 | |
| SCHEMBL235730 | 0.85 | CHRNA7 (0.44) | CHRNB2CHRNA4CHRNA7 | |
| SCHEMBL2641453 | 0.85 | CHRNA7 (0.44) | CHRNB2CHRNA4CHRNA7 | |
| SCHEMBL4316440 | 0.85 | CHRNA7 (0.44) | CHRNB2CHRNA4CHRNA7 | |
| Hydrochloric Acid SCHEMBL29369063 | 0.85 | CHRNA7 (0.45) | CHRNB2CHRNA4CHRNA7 | |
| SCHEMBL15307685 | 0.78 | CHRNB2 (0.49) | CHRNB2CHRNA4CHRNA3CHRNB4CYP3A4 | |
| SCHEMBL4320113 | 0.78 | CHRNB2 (0.48) | CHRNB2CHRNA4CHRNA3CHRNB4CHRNA7 | |
| SCHEMBL4308561 | 0.77 | CHRNA7 (0.47) | CHRNA7 | |
| SCHEMBL7465003 | 0.76 | HRH4 (0.54) | CHRNB2CHRNA4CHRNA3CHRNB4CYP3A4 |
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-1178973-A2 | NOVEL COMPOUNDS, THEIR USE AND PREPARATION | Pharmacia AB (SE) | 2002-02-13 | — | — | EP | disclosed |
| WO-2000076984-A2 | NOVEL COMPOUNDS, THEIR USE AND PREPARATION | BIOVITRUM AB (SE) | 2000-12-21 | — | — | WO | disclosed |