Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 5/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 5/20 | 0.35 |
| ▸ | CA2 | P00918 | 6/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.34 |
| ▸ | KMO | O15229 | 1/20 | 0.34 |
| ▸ | FASN | P49327 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL747523 | 0.80 | CHRNA7 (0.48) | CHRNA7KCNH2NAAACA12CA2 | |
| SCHEMBL746896 | 0.80 | CHRNA7 (0.48) | CHRNA7KCNH2NAAACA12CA2 | |
| Trifluoroacetic Acid SCHEMBL989041 | 0.73 | CHRNA7 (0.42) | CHRNA7KCNH2CA12KMOHTR3A | |
| SCHEMBL17004244 | 0.69 | CHRNA7 (0.43) | CHRNA7KCNH2NAAACA12CA2 | |
| SCHEMBL745399 | 0.63 | CHRNA7 (0.53) | CHRNA7KCNH2DYRK1AKMOCHRNB2 | |
| SCHEMBL745398 | 0.63 | CHRNA7 (0.53) | CHRNA7KCNH2DYRK1AKMOCHRNB2 | |
| SCHEMBL748125 | 0.62 | CHRNA7 (0.48) | CHRNA7KCNH2DYRK1AKMOCHRNB2 | |
| SCHEMBL748124 | 0.62 | CHRNA7 (0.48) | CHRNA7KCNH2DYRK1AKMOCHRNB2 | |
| SCHEMBL2484827 | 0.61 | CHRNA7 (0.49) | CHRNA7KCNH2CHRNB4CHRNA3CHRNB2 | |
| SCHEMBL2484828 | 0.61 | CHRNA7 (0.49) | CHRNA7KCNH2CHRNB4CHRNA3CHRNB2 |
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-2431368-A1 | CNS active fused bicycloheterocycle substituted azabicyclic alkane derivatives | Abbott Laboratories (US) | 2012-03-21 | — | — | EP | disclosed |