Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.59 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.43 |
| ▸ | NAAA | Q02083 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ACP1 | P24666 | 7/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CPN1 | P15169 | 1/20 | 0.34 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.34 |
| ▸ | EED | O75530 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9676206 | 0.95 | SIGMAR1 (0.52) | SIGMAR1HRH3NAAAHRH4KMT2A | |
| SCHEMBL12120615 | 0.89 | SIGMAR1 (0.53) | SIGMAR1HRH3NAAAHRH4ALDH1A1 | |
| SCHEMBL2921249 | 0.87 | HRH3 (0.41) | SIGMAR1HRH3NAAAHRH4KMT2A | |
| SCHEMBL5237679 | 0.87 | SIGMAR1 (0.45) | SIGMAR1HRH3NAAAHRH4KMT2A | |
| SCHEMBL9727925 | 0.85 | SIGMAR1 (0.44) | SIGMAR1HRH3HRH4ACP1 | |
| Hydrochloric Acid SCHEMBL30911772 | 0.85 | HRH3 (0.41) | SIGMAR1HRH3NAAAHRH4KMT2A | |
| SCHEMBL9727916 | 0.85 | SIGMAR1 (0.42) | SIGMAR1HRH3NAAAHRH4KMT2A | |
| SCHEMBL5233945 | 0.83 | SIGMAR1 (0.41) | SIGMAR1HRH3NAAAHRH4KMT2A | |
| SCHEMBL22923814 | 0.83 | SIGMAR1 (0.46) | SIGMAR1HRH3HRH4ALDH1A1TSHR | |
| SCHEMBL9668684 | 0.83 | HRH3 (0.41) | SIGMAR1HRH3NAAAHRH4KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0306698-B1 | CONDENSED DIAZEPINONES, PROCESSES FOR THEIR PREPARATION, AND MEDICAMENTS CONTAINING THESE COMPOUNDS | Dr. Karl Thomae GmbH (DE) | 1992-03-25 | — | — | EP | disclosed |
| US-4931436-A | BRADYCARDIAL AGENTS | DR. KARL THOMAE GMBH (DE) | 1990-06-05 | — | — | US | disclosed |
| EP-0306698-A1 | Condensed diazepinones, processes for their preparation, and medicaments containing these compounds | Dr. Karl Thomae GmbH (DE) | 1989-03-15 | — | — | EP | disclosed |