Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HTR5A | P47898 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 9/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 8/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 8/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 8/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 8/20 | 0.35 |
| ▸ | MPO | P05164 | 1/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 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 | |
|---|---|---|---|---|
| SCHEMBL3227705 | 1.00 | SIGMAR1 (0.41) | SIGMAR1HTTNPSR1HTR5ANPC1 | |
| SCHEMBL3223958 | 0.86 | CHRM3 (0.40) | HTTNPSR1CHRM3CHRM2CHRM4 | |
| SCHEMBL14101280 | 0.86 | CHRM3 (0.38) | SIGMAR1HTTNPSR1CHRM3CHRM2 | |
| SCHEMBL3223966 | 0.86 | CHRM3 (0.40) | HTTNPSR1CHRM3CHRM2CHRM4 | |
| SCHEMBL27774376 | 0.82 | CHRM3 (0.40) | SIGMAR1CHRM3CHRM2CHRM4CHRM5 | |
| SCHEMBL27736539 | 0.82 | CHRM3 (0.40) | SIGMAR1CHRM3CHRM2CHRM4CHRM5 | |
| SCHEMBL3221153 | 0.82 | CHRM3 (0.40) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL27795281 | 0.82 | CHRM3 (0.40) | SIGMAR1CHRM3CHRM2CHRM4CHRM5 | |
| SCHEMBL1109823 | 0.82 | CHRM3 (0.40) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL4741150 | 0.82 | GAA (0.43) | SIGMAR1GAAMAPTCHRM2MPO |
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-2010015792-A1 | NITROGEN CONTAINING HETEROCYCLIC COMPOUNDS USEFUL AS BIFUNCTIONAL MODULATORS OF M3 RECEPTORS AND BETA-2 RECEPTORS | ARGENTA DISCOVERY LIMITED (GB) | 2010-02-11 | — | — | WO | disclosed |
| WO-2008096129-A1 | NITROGEN CONTAINING HETROCYCLIC COMPOUNDS USEFUL AS BIFUNCTIONAL MODULATORS OF M3 RECEPTORS AND BETA- 2 RECEPTORS | ARGENTA DISCOVERY LTD (GB) | 2008-08-14 | — | — | WO | disclosed |