Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA3 | P32297 | 5/20 | 0.63 |
| ▸ | CHRNB4 | P30926 | 4/20 | 0.57 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.57 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.53 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.53 |
| ▸ | CHRNB1 | P11230 | 3/20 | 0.53 |
| ▸ | CHRNB3 | Q05901 | 3/20 | 0.53 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.51 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.51 |
| ▸ | PRKCG | P05129 | 1/20 | 0.51 |
| ▸ | PIM1 | P11309 | 1/20 | 0.51 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.51 |
| ▸ | AKT1 | P31749 | 1/20 | 0.51 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.51 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.51 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.51 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.51 |
| ▸ | STK3 | Q13188 | 1/20 | 0.51 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.51 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7824609 | 1.00 | CHRNA3 (0.63) | CHRNA3CHRNB4CHRNA7CHRNB2CHRNA4 | |
| SCHEMBL7825587 | 0.92 | CHRNB4 (0.67) | CHRNA3CHRNB4CHRNA7CHRNB2CHRNA4 | |
| SCHEMBL7827114 | 0.92 | CHRNB4 (0.67) | CHRNA3CHRNB4CHRNA7CHRNB2CHRNA4 | |
| SCHEMBL7413944 | 0.87 | CHRNA3 (0.64) | CHRNA3CHRNB4CHRNA7CHRNB2CHRNA4 | |
| SCHEMBL7410468 | 0.87 | CHRNA3 (0.64) | CHRNA3CHRNB4CHRNA7CHRNB2CHRNA4 | |
| Hydrochloric Acid SCHEMBL7827784 | 0.86 | CHRNA3 (0.63) | CHRNA3CHRNB4CHRNA7CHRNB2CHRNA4 | |
| Hydrochloric Acid SCHEMBL7827655 | 0.86 | CHRNA3 (0.63) | CHRNA3CHRNB4CHRNA7CHRNB2CHRNA4 | |
| SCHEMBL7828152 | 0.86 | CHRNA3 (0.58) | CHRNA3CHRNB4CHRNB2CHRNA4CHRNB1 | |
| SCHEMBL7825054 | 0.86 | CHRNA3 (0.58) | CHRNA3CHRNB4CHRNB2CHRNA4CHRNB1 | |
| SCHEMBL7410204 | 0.85 | CHRNA3 (0.61) | CHRNA3CHRNB4CHRNA7CHRNB2CHRNA4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0846114-B1 | 3-PYRIDYLOXYALKYL HETEROCYCLIC ETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION | ABBOTT LAB (US) | 2001-12-05 | — | — | EP | claimed |
| EP-0846114-B1 | 3-PYRIDYLOXYALKYL HETEROCYCLIC ETHER COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION | ABBOTT LAB (US) | 2001-12-05 | — | — | EP | disclosed |