Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 9/20 | 0.52 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.37 |
| ▸ | PRCP | P42785 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8864671 | 0.96 | ACHE (0.51) | ACHEBCHELMNAMEN1USP2 | |
| SCHEMBL8556167 | 0.76 | KCNH2 (0.56) | LMNAKCNH2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL10377977 | 0.71 | ALPL (0.50) | ACHEBCHELMNAALDH1A1KCNH2 | |
| SCHEMBL10455191 | 0.70 | NOS1 (0.49) | ACHELMNAUSP2ALDH1A1KCNH2 | |
| SCHEMBL9540233 | 0.68 | ACHE (1.00) | ACHEBCHELMNAMEN1USP2 | |
| SCHEMBL10376372 | 0.66 | ALPL (0.51) | ACHEBCHELMNAMEN1USP2 | |
| SCHEMBL9627472 | 0.66 | SLC6A2 (0.47) | MEN1CYP3A4KMT2ASLC6A2SLC6A4 | |
| SCHEMBL809711 | 0.65 | NOS1 (0.46) | ACHEBCHELMNAMEN1USP2 | |
| SCHEMBL8864707 | 0.65 | PRCP (0.46) | ACHEKCNH2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8555627 | 0.65 | KCNH2 (0.72) | LMNAKCNH2SLC6A2SLC6A4SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |