Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNJ1 | P48048 | 4/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | MMP12 | P39900 | 1/20 | 0.40 |
| ▸ | MMP13 | P45452 | 1/20 | 0.40 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11246640 | 0.78 | KDM4E (0.45) | TSHR | |
| SCHEMBL13617597 | 0.76 | CYP2A6 (0.54) | KCNJ1KCNH2CYP2A6MMP12MMP13 | |
| SCHEMBL11236420 | 0.73 | LOXL2 (0.50) | KCNJ1KCNH2CYP2A6MMP12MMP13 | |
| SCHEMBL9501676 | 0.71 | TSHR (0.57) | KCNJ1KCNH2CYP2A6MMP12MMP13 | |
| SCHEMBL9144804 | 0.71 | CYP2A6 (0.53) | KCNJ1KCNH2CYP2A6MMP12MMP13 | |
| SCHEMBL7392719 | 0.71 | KCNJ1 (0.49) | KCNJ1KCNH2CYP2A6LOXL2TSHR | |
| SCHEMBL11525270 | 0.71 | GRIA1 (0.48) | KCNJ1KCNH2CYP2A6MMP12MMP13 | |
| SCHEMBL11525265 | 0.71 | GRIA1 (0.48) | KCNJ1KCNH2CYP2A6MMP12MMP13 | |
| SCHEMBL9498987 | 0.70 | CYP2A6 (0.52) | KCNJ1KCNH2CYP2A6MMP12MMP13 | |
| SCHEMBL8042576 | 0.70 | EPHX1 (0.47) | KCNJ1KCNH2CYP2A6MMP12MMP13 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1047695-B1 | NOVEL BISPIDINE ANTIARRHYTHMIC COMPOUNDS | ASTRAZENECA AB (SE) | 2004-03-17 | — | — | EP | disclosed |
| US-6291475-B1 | 3,7-DIAZABICYCLO(3.3.1)NONANE DERIVATIVES | ASTRAZENECA AB (SE) | 2001-09-18 | — | — | US | disclosed |
| EP-1047695-A1 | NOVEL BISPIDINE ANTIARRHYTHMIC COMPOUNDS | AstraZeneca AB (SE) | 2000-11-02 | — | — | EP | disclosed |
| WO-1999031100-A1 | NOVEL BISPIDINE ANTIARRHYTHMIC COMPOUNDS | ASTRAZENECA AB (SE) | 1999-06-24 | — | — | WO | disclosed |