Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 14/20 | 0.59 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.54 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.54 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | SPHK2 | Q9NRA0 | 2/20 | 0.47 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28290374 | 0.81 | OPRK1 (0.56) | HRH3SPHK2SPHK1TRPV6 | |
| SCHEMBL28290323 | 0.81 | SPHK2 (0.50) | HRH3SPHK2SPHK1TRPV6 | |
| SCHEMBL28872406 | 0.78 | SLC18A2 (0.53) | HRH3KCNH2SPHK2SPHK1 | |
| SCHEMBL28291886 | 0.77 | MAOB (0.48) | HRH3MAOBSPHK2SPHK1TRPV6 | |
| SCHEMBL28290308 | 0.75 | HRH3 (0.70) | HRH3KCNH2KCNJ1MAOASPHK2 | |
| SCHEMBL1640926 | 0.75 | HRH3 (1.00) | HRH3KCNH2SPHK2SPHK1 | |
| SCHEMBL1640070 | 0.75 | HRH3 (1.00) | HRH3KCNH2 | |
| SCHEMBL1640267 | 0.75 | HRH3 (1.00) | HRH3KCNH2SPHK2SPHK1 | |
| SCHEMBL1641177 | 0.75 | HRH3 (1.00) | HRH3KCNH2 | |
| SCHEMBL14375366 | 0.72 | HRH3 (0.60) | HRH3SPHK2SPHK1SLC6A4 |
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-109641878-A | DIPROVOCIM: a new class of effective TLR agonist | 斯克里普斯研究学院 | 2019-04-16 | — | — | CN | disclosed |