Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.60 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.60 |
| ▸ | CHRM2 | P08172 | 5/20 | 0.44 |
| ▸ | CHRM5 | P08912 | 5/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.44 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 4/20 | 0.44 |
| ▸ | CDC7 | O00311 | 4/20 | 0.42 |
| ▸ | PIM1 | P11309 | 4/20 | 0.42 |
| ▸ | CSNK2B | P67870 | 4/20 | 0.42 |
| ▸ | CSNK2A1 | P68400 | 4/20 | 0.42 |
| ▸ | CIT | O14578 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | CSNK2A3 | Q8NEV1 | 1/20 | 0.42 |
| ▸ | TAOK3 | Q9H2K8 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7842435 | 0.86 | CHRNB2 (0.60) | CHRNB2CHRNA4CHRM2CHRM5CHRM3 | |
| SCHEMBL7850149 | 0.86 | CHRNB2 (0.60) | CHRNB2CHRNA4CHRM2CHRM5CHRM3 | |
| Hydrochloric Acid SCHEMBL7852000 | 0.84 | CHRNB2 (0.59) | CHRNB2CHRNA4CHRM2CHRM5CHRM3 | |
| Hydrochloric Acid SCHEMBL7853473 | 0.84 | CHRNB2 (0.59) | CHRNB2CHRNA4CHRM2CHRM5CHRM3 | |
| Hydrochloric Acid SCHEMBL7852405 | 0.84 | CHRNB2 (0.59) | CHRNB2CHRNA4CHRM2CHRM5CHRM3 | |
| SCHEMBL7852290 | 0.83 | CHRNB2 (0.60) | CHRNB2CHRNA4CHRM2CHRM5CHRM3 | |
| SCHEMBL7851259 | 0.83 | CHRNB2 (0.60) | CHRNB2CHRNA4CHRM2CHRM5CHRM3 | |
| SCHEMBL7850240 | 0.83 | CHRNB2 (0.60) | CHRNB2CHRNA4CHRM2CHRM5CHRM3 | |
| SCHEMBL7842419 | 0.83 | CHRNB2 (0.60) | CHRNB2CHRNA4CHRM2CHRM5CHRM3 | |
| Hydrochloric Acid SCHEMBL7850244 | 0.82 | CHRNB2 (0.59) | CHRNB2CHRNA4CHRM2CHRM5CHRM3 |
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-0842178-B1 | FUROPYRIDINE, THIENOPYRIDINE, PYRROLOPYRIDINE AND RELATED PYRIMIDINE, PYRIDAZINE AND TRIAZINE COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION | ABBOTT LAB (US) | 2001-03-28 | — | — | EP | claimed |
| EP-0842178-B1 | FUROPYRIDINE, THIENOPYRIDINE, PYRROLOPYRIDINE AND RELATED PYRIMIDINE, PYRIDAZINE AND TRIAZINE COMPOUNDS USEFUL IN CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION | ABBOTT LAB (US) | 2001-03-28 | — | — | EP | disclosed |