Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 2/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | MOGAT2 | Q3SYC2 | 3/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20204600 | 0.90 | MAOB (0.37) | KCNH2CHRM3 | |
| SCHEMBL22861056 | 0.80 | NPC1 (0.40) | KCNH2 | |
| SCHEMBL14005563 | 0.78 | HTR1D (0.43) | KCNH2 | |
| SCHEMBL12062367 | 0.77 | HTR1D (0.42) | KCNH2 | |
| SCHEMBL13351513 | 0.74 | GABRA1 (0.35) | — | |
| SCHEMBL7495842 | 0.73 | HRH3 (0.46) | TACR1 | |
| SCHEMBL9224226 | 0.72 | MEN1 (0.38) | CYP2D6 | |
| Hydrochloric Acid SCHEMBL7982684 | 0.72 | HRH3 (0.45) | TACR1 | |
| SCHEMBL9224228 | 0.72 | MEN1 (0.38) | CYP2D6 | |
| SCHEMBL8736719 | 0.72 | MAOB (0.36) | — |
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-2018098208-A1 | NITROGEN RING LINKED DEOXYURIDINE TRIPHOSPHATASE INHIBITORS | CV6 THERAPEUTICS (NI) LIMITED (GB) | 2018-05-31 | — | — | WO | disclosed |