Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 7/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | CCR5 | P51681 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 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 | |
|---|---|---|---|---|
| SCHEMBL1306321 | 1.00 | SMN1; SMN2 (0.39) | SMN1; SMN2OPRM1HSD11B1CHRM2CHRM4 | |
| SCHEMBL1305394 | 0.90 | SMN1; SMN2 (0.44) | SMN1; SMN2OPRM1HSD11B1CHRM2CHRM3 | |
| SCHEMBL2523794 | 0.82 | CCR5 (0.37) | OPRM1CCR5OPRL1 | |
| SCHEMBL2523790 | 0.82 | CCR5 (0.37) | OPRM1CCR5OPRL1 | |
| SCHEMBL26619779 | 0.81 | OPRM1 (0.41) | OPRM1SIGMAR1CCR5HRH3 | |
| SCHEMBL26619784 | 0.81 | OPRM1 (0.41) | OPRM1SIGMAR1CCR5HRH3 | |
| SCHEMBL1307812 | 0.79 | OPRM1 (0.55) | OPRM1CHRM2CHRM4CHRM3SIGMAR1 | |
| SCHEMBL13738460 | 0.78 | HRH3 (0.43) | SMN1; SMN2OPRM1CHRM2CHRM4CHRM5 | |
| SCHEMBL15668110 | 0.78 | HRH3 (0.43) | SMN1; SMN2OPRM1CHRM2CHRM4CHRM5 | |
| SCHEMBL13738461 | 0.78 | HRH3 (0.43) | SMN1; SMN2OPRM1CHRM2CHRM4CHRM5 |
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-2011121309-A1 | PHENYL SULFONYL DERIVATIVES AND THEIR USE AS HISTAMINE H3 ANTAGONISTS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2011-10-06 | — | — | WO | disclosed |