Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 8/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 9/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 8/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | CHRM4 | P08173 | 5/20 | 0.32 |
| ▸ | CHRM5 | P08912 | 5/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL4725321 | 0.84 | HRH1 (0.39) | CHRM3CHRM2CHRM1KCNH2CYP2D6 | |
| SCHEMBL4779865 | 0.83 | CHRM2 (0.36) | CHRM3CHRM2CHRM1KCNH2CYP2D6 | |
| SCHEMBL4726224 | 0.81 | CHRM2 (0.37) | CHRM3CHRM2CHRM1KCNH2CYP2D6 | |
| SCHEMBL4726435 | 0.81 | CHRM3 (0.36) | CHRM3CHRM2CHRM1KCNH2CYP2D6 | |
| Bromide SCHEMBL4728212 | 0.80 | CHRM2 (0.36) | CHRM3CHRM2CHRM1KCNH2CYP2D6 | |
| SCHEMBL4726613 | 0.79 | TSHR (0.35) | CHRM3CHRM2CHRM1KCNH2CYP2D6 | |
| SCHEMBL4727450 | 0.79 | CHRM3 (0.35) | CHRM3CHRM2CHRM1KCNH2CYP2D6 | |
| SCHEMBL4779634 | 0.78 | CHRM3 (0.39) | CHRM3CHRM2CHRM1KCNH2CYP2D6 | |
| SCHEMBL4726718 | 0.78 | CHRM3 (0.35) | CHRM3CHRM2CHRM1KCNH2CYP2D6 | |
| SCHEMBL4727653 | 0.78 | CHRM3 (0.35) | CHRM3CHRM2CHRM1KCNH2CYP19A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008023157-A1 | NITROGEN CONTAINING HETEROCYCLIC COMPOUNDS USEFUL AS M3-RECEPTOR MODULATORS | ARGENTA DISCOVERY LIMITED (GB) | 2008-02-28 | — | — | WO | disclosed |
| WO-2008023157-A1 | NITROGEN CONTAINING HETEROCYCLIC COMPOUNDS USEFUL AS M3-RECEPTOR MODULATORS | ARGENTA DISCOVERY LIMITED (GB) | 2008-02-28 | — | — | WO | disclosed |