Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.62 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.62 |
| ▸ | HTR1B | P28222 | 4/20 | 0.53 |
| ▸ | HTR1D | P28221 | 2/20 | 0.53 |
| ▸ | CDC7 | O00311 | 1/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.42 |
| ▸ | PIM1 | P11309 | 1/20 | 0.42 |
| ▸ | PRKACA | P17612 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | HIPK2 | Q9H2X6 | 1/20 | 0.42 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.37 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7102684 | 0.79 | DRD2 (0.42) | CHRNB2CHRNA4 | |
| SCHEMBL30756567 | 0.77 | CHRNB2 (1.00) | CHRNB2CHRNA4HTR1BHTR1D | |
| SCHEMBL29244418 | 0.77 | CHRNB2 (0.40) | CHRNB2CHRNA4HTR1BHTR1DCHRNB4 | |
| SCHEMBL7101352 | 0.77 | CHRNB2 (1.00) | CHRNB2CHRNA4HTR1BHTR1D | |
| SCHEMBL10158177 | 0.76 | CA12 (0.42) | CHRNB2CHRNA4KDM4EALDH1A1CHRNB4 | |
| SCHEMBL1935365 | 0.75 | HTR1B (0.64) | CHRNB2CHRNA4HTR1BHTR1DKDM4E | |
| SCHEMBL24271048 | 0.74 | CYP2D6 (0.52) | KDM4EALDH1A1LMNA | |
| SCHEMBL30625798 | 0.74 | CHRNB2 (0.41) | CHRNB2CHRNA4ALDH1A1 | |
| SCHEMBL19744084 | 0.73 | MTNR1A (0.45) | ALDH1A1LMNA | |
| SCHEMBL7547843 | 0.72 | CHRNB2 (0.39) | CHRNB2CHRNA4HTR1BHTR1DALDH1A1 |
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 |