Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.54 |
| ▸ | DRD2 | P14416 | 2/20 | 0.54 |
| ▸ | DRD3 | P35462 | 2/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.50 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.50 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.50 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL6002385 | 0.86 | KCNH2 (0.52) | KCNH2DRD2DRD3CYP2D6SLC6A2 | |
| SCHEMBL14615319 | 0.86 | KCNH2 (0.52) | KCNH2DRD2DRD3CYP2D6SLC6A2 | |
| SCHEMBL4075128 | 0.86 | KCNH2 (0.52) | KCNH2DRD2DRD3CYP2D6SLC6A2 | |
| SCHEMBL6003339 | 0.86 | KCNH2 (0.52) | KCNH2DRD2DRD3CYP2D6SLC6A2 | |
| SCHEMBL11084602 | 0.84 | DRD2 (0.43) | KCNH2DRD2DRD3 | |
| SCHEMBL4073749 | 0.84 | KCNH2 (0.51) | KCNH2DRD2DRD3CYP2D6SLC6A2 | |
| Hydrochloric Acid SCHEMBL5437235 | 0.84 | KCNH2 (0.51) | KCNH2DRD2DRD3CYP2D6SLC6A2 | |
| SCHEMBL11084454 | 0.84 | KCNH2 (0.54) | KCNH2DRD2DRD3CYP2D6SLC6A2 | |
| SCHEMBL13312896 | 0.84 | KCNH2 (0.50) | KCNH2DRD2DRD3CYP2D6SLC6A2 | |
| SCHEMBL7031873 | 0.84 | KCNH2 (0.50) | KCNH2DRD2DRD3CYP2D6SLC6A2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4131611-A | ANXIOLYTIC, ANALGESIC | AMERICAN CYANAMID COMPANY (US) | 1978-12-26 | — | — | US | claimed |
| US-4435419-A | Method of treating depression using azabicyclohexanes | AMERICAN CYANAMID COMPANY (US) | 1984-03-06 | — | — | US | disclosed |
| US-4231935-A | ANXIOLYTICS AND ANALGESICS | AMERICAN CYANAMID COMPANY (US) | 1980-11-04 | — | — | US | disclosed |
| US-4196120-A | 1,2-BIS(HYDROCARBYLSULFONYLOXY OR HALO METHYL)CYCLOPROPYLBENZENE, OPTICAL ACITIVITY ANALGESICS | AMERICAN CYANAMID COMPANY (US) | 1980-04-01 | — | — | US | disclosed |
| US-4131611-A | ANXIOLYTIC, ANALGESIC | AMERICAN CYANAMID COMPANY (US) | 1978-12-26 | — | — | US | disclosed |