Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPN1 | P15169 | 1/20 | 0.40 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | EED | O75530 | 3/20 | 0.36 |
| ▸ | SLC6A1 | P30531 | 4/20 | 0.35 |
| ▸ | SLC6A11 | P48066 | 3/20 | 0.35 |
| ▸ | SLC6A13 | Q9NSD5 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.34 |
| ▸ | SLC6A12 | P48065 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9917291 | 0.85 | HRH3 (0.40) | CPN1CPB2KMT2AHRH3HRH4 | |
| SCHEMBL14646583 | 0.85 | HRH3 (0.40) | CPN1CPB2KMT2AHRH3HRH4 | |
| SCHEMBL14071147 | 0.85 | HRH3 (0.40) | CPN1CPB2KMT2AHRH3HRH4 | |
| SCHEMBL13174686 | 0.84 | GNAO1 (0.33) | CPN1CPB2SLC6A1SLC6A11SLC6A13 | |
| SCHEMBL11915915 | 0.79 | HRH3 (0.35) | CPN1CPB2KMT2AHRH3HRH4 | |
| SCHEMBL20668640 | 0.78 | HRH3 (0.36) | CPN1CPB2KMT2AHRH3HRH4 | |
| SCHEMBL20668637 | 0.78 | HRH3 (0.36) | CPN1CPB2KMT2AHRH3HRH4 | |
| SCHEMBL23187462 | 0.78 | — | — | |
| SCHEMBL20259719 | 0.77 | HRH3 (0.35) | CPN1CPB2KMT2AHRH3HRH4 | |
| SCHEMBL9085173 | 0.77 | CPN1 (0.39) | CPN1CPB2KMT2AHRH3HRH4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018045950-A1 | CYCLOHEXENE COMPOUNDS AND USE THEREOF | 广州市恒诺康医药科技有限公司 | 2018-03-15 | — | — | WO | disclosed |