Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 14/20 | 0.64 |
| ▸ | CHRNB2 | P17787 | 7/20 | 0.55 |
| ▸ | CHRNA4 | P43681 | 7/20 | 0.55 |
| ▸ | CHRNB4 | P30926 | 6/20 | 0.55 |
| ▸ | CHRNA3 | P32297 | 6/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.46 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.35 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.35 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.35 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29604852 | 1.00 | CHRNA7 (0.64) | CHRNA7CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL17004212 | 0.85 | CHRNA7 (0.56) | CHRNA7CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL29604064 | 0.82 | KCNH2 (0.47) | CHRNA7CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL17004276 | 0.82 | KCNH2 (0.47) | CHRNA7CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL17004229 | 0.80 | CHRNA7 (0.48) | CHRNA7CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL29604864 | 0.80 | CHRNA7 (0.47) | CHRNA7CHRNB2CHRNA4CHRNB4CHRNA3 | |
| SCHEMBL17004358 | 0.79 | CHRNA7 (0.56) | CHRNA7CHRNB2CHRNA4CHRNB4CHRNA3 | |
| Abt-107 SCHEMBL31393053 | 0.78 | CHRNA7 (1.00) | CHRNA7CHRNB2CHRNA4CHRNB4CHRNA3 | |
| Abt-107 SCHEMBL373047 | 0.78 | CHRNA7 (1.00) | CHRNA7CHRNB2CHRNA4CHRNB4CHRNA3 | |
| Abt-107 SCHEMBL1542259 | 0.78 | CHRNA7 (1.00) | CHRNA7CHRNB2CHRNA4CHRNB4CHRNA3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2099795-B1 | AZAADAMANTANE DERIVATIVES AND THEIR USES AS NICOTINIC ACETYLCHOLINE RECEPTORS LIGANDS | ABBVIE BAHAMAS LTD (BS) | 2015-08-19 | — | — | EP | disclosed |