Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.62 |
| ▸ | SIGMAR1 | Q99720 | 6/20 | 0.52 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.50 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | RAD52 | P43351 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13978815 | 1.00 | HRH3 (0.62) | HRH3SIGMAR1CHRM5ADRA2CCYP1A2 | |
| SCHEMBL12130736 | 0.98 | HRH3 (0.58) | HRH3SIGMAR1CHRM5ADRA2CCYP1A2 | |
| SCHEMBL30115019 | 0.91 | HRH3 (0.54) | HRH3SIGMAR1CHRM5ADRA2CCYP1A2 | |
| SCHEMBL11841456 | 0.91 | SIGMAR1 (0.50) | HRH3SIGMAR1CHRM5ADRA2CCYP1A2 | |
| SCHEMBL30115021 | 0.91 | HRH3 (0.54) | HRH3SIGMAR1CHRM5ADRA2CCYP1A2 | |
| SCHEMBL21252640 | 0.89 | HRH3 (0.52) | HRH3SIGMAR1 | |
| SCHEMBL5467402 | 0.87 | CYP1A2 (0.48) | HRH3SIGMAR1CHRM5ADRA2CCYP1A2 | |
| SCHEMBL8034284 | 0.86 | CYP1A2 (0.55) | HRH3SIGMAR1CYP1A2 | |
| SCHEMBL10867697 | 0.83 | SIGMAR1 (0.53) | HRH3SIGMAR1CHRM5RAD52 | |
| SCHEMBL7126423 | 0.82 | GNAO1 (0.57) | HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0591426-A1 | SIGMA RECEPTOR LIGANDS AND THE USE THEREOF | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 1994-04-13 | — | — | EP | claimed |
| WO-1993000313-A2 | SIGMA RECEPTOR LIGANDS AND THE USE THEREOF | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 1993-01-07 | — | — | WO | claimed |