Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | DRD4 | P21917 | 1/20 | 0.51 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.51 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | NAMPT | P43490 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL2978233 | 0.83 | SCN8A (0.55) | SCN8ACYP1A2CYP2D6CHRM2ALDH1A1 | |
| SCHEMBL10857113 | 0.80 | ALDH1A1 (0.53) | SCN8ACYP1A2CYP2D6CHRM2ALDH1A1 | |
| SCHEMBL10856250 | 0.80 | KMT2A (0.64) | SCN8ACYP1A2CYP2D6CHRM2ALDH1A1 | |
| SCHEMBL7103959 | 0.79 | DRD4 (0.64) | SCN8ACHRM2DRD4CHRNB2CHRNA4 | |
| SCHEMBL29875178 | 0.79 | CYP1A2 (0.83) | SCN8ACYP1A2CYP2D6CHRM2ALDH1A1 | |
| SCHEMBL19031318 | 0.79 | CYP1A2 (0.83) | SCN8ACYP1A2CYP2D6CHRM2ALDH1A1 | |
| SCHEMBL5113242 | 0.78 | CYP1A2 (0.65) | SCN8ACYP1A2CYP2D6CHRM2ALDH1A1 | |
| SCHEMBL23067927 | 0.77 | CHRNB2 (0.74) | DRD4CHRNB2CHRNA4 | |
| SCHEMBL30756757 | 0.77 | CHRNB2 (0.74) | DRD4CHRNB2CHRNA4 | |
| SCHEMBL10859125 | 0.77 | SCN8A (0.66) | SCN8ACYP1A2CYP2D6CHRM2ALDH1A1 |
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 |