Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | PRCP | P42785 | 1/20 | 0.42 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11738746 | 0.82 | SIGMAR1 (0.42) | SIGMAR1SLC6A2SLC6A4SLC6A3PRCP | |
| Bromide SCHEMBL11733211 | 0.81 | SIGMAR1 (0.41) | SIGMAR1SLC6A2SLC6A4SLC6A3OPRD1 | |
| SCHEMBL11682895 | 0.80 | KCNH2 (0.57) | SIGMAR1SLC6A2SLC6A4SLC6A3PRCP | |
| SCHEMBL11867362 | 0.75 | PRCP (0.50) | SIGMAR1PRCPOPRD1KCNH2 | |
| SCHEMBL11858464 | 0.75 | OPRD1 (0.47) | SIGMAR1PRCPOPRD1KCNH2 | |
| SCHEMBL11742682 | 0.75 | HTR2A (0.38) | SIGMAR1SLC6A2SLC6A4 | |
| SCHEMBL11864088 | 0.75 | SIGMAR1 (0.54) | SIGMAR1OPRD1ADRA2A | |
| SCHEMBL11734796 | 0.74 | DRD2 (0.55) | SIGMAR1SLC6A2SLC6A4SLC6A3KCNH2 | |
| SCHEMBL11857141 | 0.73 | SIGMAR1 (0.50) | SIGMAR1PRCPOPRD1KCNH2ADRA2A | |
| SCHEMBL11733261 | 0.72 | OPRD1 (0.50) | SIGMAR1PRCPOPRD1KCNH2 |
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-4031224-A | 1,3-Dihydro-heteroarylspiro (isobenzofuran)s | AMERICAN HOECHST CORPORATION (US) | 1977-06-21 | — | — | US | claimed |
| US-4031224-A | 1,3-Dihydro-heteroarylspiro (isobenzofuran)s | AMERICAN HOECHST CORPORATION (US) | 1977-06-21 | — | — | US | disclosed |