Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 15/20 | 0.49 |
| ▸ | CA12 | O43570 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.42 |
| ▸ | CA2 | P00918 | 3/20 | 0.42 |
| ▸ | CA9 | Q16790 | 3/20 | 0.42 |
| ▸ | CA7 | P43166 | 2/20 | 0.42 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7096961 | 1.00 | CHRNA7 (0.49) | CHRNA7CA12CA1CA2CA9 | |
| SCHEMBL7006389 | 0.83 | MAOA (0.37) | CHRNA7CA12CA1CA2CA9 | |
| SCHEMBL7096728 | 0.83 | MAOA (0.42) | CHRNA7CA12CA1CA2CA9 | |
| SCHEMBL7096726 | 0.83 | MAOA (0.42) | CHRNA7CA12CA1CA2CA9 | |
| SCHEMBL7002740 | 0.78 | MAOA (0.51) | KDM1AMAOAMAOB | |
| SCHEMBL6753603 | 0.76 | KDM1A (0.49) | KDM1AMAOAMAOB | |
| SCHEMBL6753602 | 0.76 | KDM1A (0.49) | KDM1AMAOAMAOB | |
| SCHEMBL7003744 | 0.76 | DRD2 (0.42) | — | |
| SCHEMBL23107750 | 0.75 | CHRNA7 (0.47) | CHRNA7CA12CA1CA2CA9 | |
| SCHEMBL19378449 | 0.75 | CHRNA7 (0.47) | CHRNA7CA12CA1CA2CA9 |
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-1097153-B1 | NOVEL TRIAZOLO[4,5-D]PYRIMIDINE COMPOUNDS | ASTRAZENECA AB (SE) | 2003-10-01 | — | — | EP | disclosed |