Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA3 | P32297 | 2/20 | 0.46 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.46 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.46 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.46 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.46 |
| ▸ | CHRNG | P07510 | 1/20 | 0.46 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.46 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.46 |
| ▸ | CHRND | Q07001 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7097966 | 0.89 | CHRNA3 (0.49) | CHRNA3CHRNB2CHRNA4CHRNA1CHRNG | |
| SCHEMBL7103614 | 0.87 | HRH3 (0.48) | CHRNA3CHRNB2CHRNA4CHRNB4 | |
| SCHEMBL7417656 | 0.74 | CHRNB2 (0.73) | CHRNA3CHRNA7CHRNB2CHRNA4CHRNB4 | |
| SCHEMBL8436385 | 0.71 | CHRNB2 (0.59) | CHRNA3CHRNA7CHRNB2CHRNA4CHRNA1 | |
| SCHEMBL14949866 | 0.71 | CHRNB2 (0.83) | CHRNA3CHRNB2CHRNA4 | |
| SCHEMBL14949865 | 0.71 | CHRNB2 (0.83) | CHRNA3CHRNB2CHRNA4 | |
| Hydrochloric Acid SCHEMBL7410981 | 0.70 | CHRNB2 (0.58) | CHRNA3CHRNA7CHRNB2CHRNA4CHRNA1 | |
| SCHEMBL6608164 | 0.70 | CHRNB2 (0.58) | CHRNA3CHRNA7CHRNB2CHRNA4CHRNA1 | |
| SCHEMBL9152567 | 0.70 | KDM1A (0.37) | CYP2D6 | |
| SCHEMBL6584512 | 0.70 | CHRNB2 (0.75) | CHRNB2CHRNA4KDM4ECYP1A2CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2003500393-A | — | — | 2003-01-07 | — | — | JP | claimed |
| EP-1185513-A2 | ARYL SUBSTITUTED ALKYLAMINES CAPABLE OF ACTIVATING NICOTINIC CHOLINERGIC RECEPTORS | Targacept, Inc. (US) | 2002-03-13 | — | — | EP | claimed |
| WO-2000071520-A2 | ARYL SUBSTITUTED ALKYLAMINES CAPABLE OF ACTIVATING NICOTINIC CHOLINERGIC RECEPTORS | TARGACEPT, INC. (US) | 2000-11-30 | — | — | WO | claimed |