Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRD1 | P41143 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.41 |
| ▸ | HTR2A | P28223 | 3/20 | 0.39 |
| ▸ | PRCP | P42785 | 5/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11781458 | 0.92 | OPRD1 (0.46) | OPRD1KCNH2SIGMAR1HTR2APRCP | |
| SCHEMBL4363631 | 0.82 | OPRD1 (0.50) | OPRD1KCNH2SIGMAR1PRCPDRD2 | |
| SCHEMBL29705809 | 0.82 | OPRD1 (0.50) | OPRD1KCNH2SIGMAR1PRCPDRD2 | |
| SCHEMBL11742682 | 0.81 | HTR2A (0.38) | SIGMAR1HTR2AALDH1A1DRD2SLC6A2 | |
| SCHEMBL11840739 | 0.75 | OPRD1 (0.51) | OPRD1KCNH2SIGMAR1PRCP | |
| SCHEMBL11845021 | 0.74 | OPRD1 (0.50) | OPRD1KCNH2SIGMAR1PRCP | |
| SCHEMBL11334162 | 0.72 | OPRD1 (0.49) | OPRD1KCNH2SIGMAR1PRCPALDH1A1 | |
| SCHEMBL11334163 | 0.72 | OPRD1 (0.49) | OPRD1KCNH2SIGMAR1PRCPALDH1A1 | |
| SCHEMBL11368769 | 0.72 | OPRD1 (0.52) | OPRD1KCNH2SIGMAR1PRCP | |
| SCHEMBL11870107 | 0.72 | SIGMAR1 (0.43) | OPRD1KCNH2SIGMAR1PRCP |
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 |
|---|---|---|---|---|---|---|---|
| US-3996354-A | 1,3-Dihydro-1'-dimethylphosphinylalkyl-3-phenylspiro(isobenzofuran)s | AMERICAN HOECHST CORPORATION (US) | 1976-12-07 | — | — | US | disclosed |
| US-3980786-A | 1,3-Dihydro-3-phenyl-1'-(2-propynyl)spiro[isobenzofuran]s | AMERICAN HOECHST CORPORATION (US) | 1976-09-14 | — | — | US | disclosed |