Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.51 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 3/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12836645 | 0.80 | OPRM1 (0.36) | SIGMAR1DRD2DRD3OPRM1OPRL1 | |
| SCHEMBL12836222 | 0.76 | OPRM1 (0.41) | SIGMAR1OPRM1OPRD1OPRK1OPRL1 | |
| SCHEMBL6747981 | 0.74 | SIGMAR1 (0.56) | SIGMAR1DRD2DRD3ALDH1A1TSHR | |
| SCHEMBL12179327 | 0.71 | CHRM2 (0.38) | SIGMAR1HSD11B1HTR1ACHRM2CHRM4 | |
| SCHEMBL17376311 | 0.71 | SIGMAR1 (0.43) | SIGMAR1DRD2DRD3CHRNB4CHRNA3 | |
| SCHEMBL8586983 | 0.70 | SLC6A4 (0.61) | SIGMAR1DRD2DRD3ALDH1A1TSHR | |
| SCHEMBL7542807 | 0.69 | SIGMAR1 (0.72) | SIGMAR1DRD2DRD3ALDH1A1TSHR | |
| SCHEMBL29965651 | 0.69 | SIGMAR1 (0.72) | SIGMAR1DRD2DRD3ALDH1A1TSHR | |
| SCHEMBL12836642 | 0.69 | HTR1A (0.50) | SIGMAR1DRD2DRD3HTR1ACHRM2 | |
| SCHEMBL30368868 | 0.68 | SIGMAR1 (1.00) | SIGMAR1DRD2DRD3CHRM2CHRM4 |
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-2011033255-A1 | (4-PHENYL-PIPERIDIN-1-YL)-[5-1H-PYRAZOL-4YL)-THIOPHEN-3-YL]-METHANONE COMPOUNDS AND THEIR USE | THE UNIVERSITY OF EDINBURGH (GB) | 2011-03-24 | — | — | WO | disclosed |