Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.56 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8556647 | 0.84 | KCNH2 (0.61) | KCNH2SLC6A2SLC6A4SLC6A3DRD3 | |
| SCHEMBL8864926 | 0.81 | KCNH2 (0.72) | KCNH2SLC6A2SLC6A4SLC6A3DRD3 | |
| SCHEMBL8556398 | 0.72 | KCNH2 (1.00) | KCNH2SLC6A2SLC6A4SLC6A3TSHR | |
| SCHEMBL8554712 | 0.72 | KCNH2 (1.00) | KCNH2SLC6A2SLC6A4SLC6A3TSHR | |
| SCHEMBL8555810 | 0.72 | KCNH2 (1.00) | KCNH2SLC6A2SLC6A4SLC6A3TSHR | |
| SCHEMBL14509742 | 0.71 | EPHX2 (0.41) | KCNH2SLC6A2SLC6A4SLC6A3DRD3 | |
| SCHEMBL8865110 | 0.70 | SLC6A2 (0.52) | KCNH2SLC6A2SLC6A4SLC6A3HTR2A | |
| SCHEMBL8555627 | 0.70 | KCNH2 (0.72) | KCNH2SLC6A2SLC6A4SLC6A3TSHR | |
| SCHEMBL8558645 | 0.70 | KCNH2 (0.72) | KCNH2SLC6A2SLC6A4SLC6A3TSHR | |
| SCHEMBL8557530 | 0.70 | KCNH2 (0.72) | KCNH2SLC6A2SLC6A4SLC6A3TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5624922-A | Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents | STERLING WINTHROP INC. (US) | 1997-04-29 | — | — | US | disclosed |
| US-5380721-A | Aryl-fused and hetaryl-fused-2,4-diazepine and 2,4-diazocine antiarrhythmic agents | STERLING WINTHROP INC. (US) | 1995-01-10 | — | — | US | disclosed |
| EP-0475527-A2 | Aryl-fused and hetaryl-fused-2, 4-diazepine and 2, 4-diazocine antiarrhythmic agents | STERLING DRUG INC. (US) | 1992-03-18 | — | — | EP | disclosed |