Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 3/20 | 0.42 |
| ▸ | HTR2C | P28335 | 3/20 | 0.42 |
| ▸ | HTR2B | P41595 | 3/20 | 0.42 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.36 |
| ▸ | KCNK3 | O14649 | 8/20 | 0.35 |
| ▸ | KCNK9 | Q9NPC2 | 8/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.34 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.33 |
| ▸ | NNMT | P40261 | 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 | |
|---|---|---|---|---|
| SCHEMBL30359044 | 0.89 | HTR2A (0.41) | HTR2AHTR2CHTR2BCHRNA4KCNK3 | |
| SCHEMBL30359111 | 0.89 | HTR2A (0.41) | HTR2AHTR2CHTR2BCHRNA4KCNK3 | |
| SCHEMBL30359053 | 0.87 | KCNK3 (0.42) | HTR2AHTR2CHTR2BKCNK3KCNK9 | |
| SCHEMBL30359037 | 0.80 | KCNK3 (0.41) | HTR2AHTR2CHTR2BKCNK3KCNK9 | |
| SCHEMBL30359162 | 0.80 | MGLL (0.43) | HTR2AHTR2CHTR2BKCNK3KCNK9 | |
| SCHEMBL30359062 | 0.76 | KCNK3 (0.48) | HTR2AHTR2CHTR2BKCNK3KCNK9 | |
| SCHEMBL30359131 | 0.76 | KCNK3 (0.47) | HTR2AHTR2CHTR2BKCNK3KCNK9 | |
| SCHEMBL20587387 | 0.72 | KCNK3 (0.46) | KCNK3KCNK9HCRTR1HCRTR2 | |
| SCHEMBL21904724 | 0.72 | KCNK3 (0.45) | KCNK3KCNK9 | |
| SCHEMBL30359095 | 0.72 | KCNK3 (0.46) | KCNK3KCNK9HCRTR1HCRTR2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116057057-A | Conjugates of alpha 2-adrenoceptor subtype C (alpha-2C) antagonists and TASK1/3 channel blockers for the treatment of sleep apnea | 拜耳公司 | 2023-05-02 | — | — | CN | disclosed |