Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 7/20 | 0.42 |
| ▸ | DRD4 | P21917 | 7/20 | 0.42 |
| ▸ | DRD3 | P35462 | 7/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL7098522 | 0.80 | CHRNB2 (0.69) | DRD2DRD4DRD3CHRNB2CHRNA4 | |
| SCHEMBL7102474 | 0.79 | CHRNB2 (0.62) | CHRNB2CHRNA4 | |
| SCHEMBL24271048 | 0.78 | CYP2D6 (0.52) | CYP2C19CYP1A2CYP2D6KMT2ATSHR | |
| SCHEMBL10158177 | 0.76 | CA12 (0.42) | CHRNB2CHRNA4CYP2C19CYP2D6MAPK1 | |
| SCHEMBL18551312 | 0.74 | DRD2 (0.50) | DRD2DRD4DRD3CHRNB2CHRNA4 | |
| SCHEMBL14068437 | 0.74 | DRD2 (0.42) | DRD2DRD4DRD3CHRNB2CHRNA4 | |
| SCHEMBL22144524 | 0.73 | DRD4 (0.74) | DRD2DRD4DRD3 | |
| SCHEMBL14030023 | 0.73 | CHRNB2 (0.44) | CHRNB2CHRNA4 | |
| SCHEMBL13463987 | 0.72 | DRD2 (0.79) | DRD2DRD4DRD3 | |
| SCHEMBL4349256 | 0.71 | — | — |
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 |