Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA3 | P07451 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA6 | P23280 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | NAAA | Q02083 | 1/20 | 0.35 |
| ▸ | ACP1 | P24666 | 8/20 | 0.35 |
| ▸ | CPN1 | P15169 | 1/20 | 0.32 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
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 | 0.90 | SIGMAR1 (0.52) | SIGMAR1HRH3HRH4KMT2ANAAA | |
| SCHEMBL28871656 | 0.86 | HRH3 (0.40) | SIGMAR1HRH3HRH4KMT2ANAAA | |
| SCHEMBL9675697 | 0.85 | SIGMAR1 (0.59) | SIGMAR1HRH3HRH4KMT2ANAAA | |
| SCHEMBL2921249 | 0.83 | HRH3 (0.41) | SIGMAR1HRH3HRH4KMT2ANAAA | |
| Hydrochloric Acid SCHEMBL30911772 | 0.81 | HRH3 (0.41) | SIGMAR1HRH3HRH4KMT2ANAAA | |
| SCHEMBL5237679 | 0.79 | SIGMAR1 (0.45) | SIGMAR1HRH3HRH4KMT2ANAAA | |
| SCHEMBL5233945 | 0.79 | SIGMAR1 (0.41) | SIGMAR1HRH3HRH4KMT2ANAAA | |
| SCHEMBL22923814 | 0.79 | SIGMAR1 (0.46) | SIGMAR1HRH3HRH4 | |
| SCHEMBL9727925 | 0.78 | SIGMAR1 (0.44) | SIGMAR1HRH3HRH4ACP1 | |
| SCHEMBL4143901 | 0.77 | HRH3 (0.42) | SIGMAR1HRH3HRH4KMT2ANAAA |
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 |
|---|---|---|---|---|---|---|---|
| US-5175158-A | CONDENSED DIAZEPINONES, PROCESSES FOR PREPARING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS | DR. KARL THOMAE, GMBH (DE) | 1992-12-29 | — | — | US | disclosed |