Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 16/20 | 0.44 |
| ▸ | PDE4A | P27815 | 11/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 11/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 11/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | TDO2 | P48775 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7802776 | 0.97 | PDE4D (0.44) | PDE4DPDE4APDE4BPDE4CCYP1A2 | |
| SCHEMBL6661186 | 0.96 | PDE4D (0.47) | PDE4DPDE4APDE4BPDE4CCYP1A2 | |
| SCHEMBL7798525 | 0.94 | PDE4D (0.43) | PDE4DPDE4APDE4BPDE4CIDO1 | |
| SCHEMBL7798646 | 0.94 | PDE4D (0.43) | PDE4DPDE4APDE4BPDE4C | |
| SCHEMBL7802856 | 0.94 | PDE4D (0.44) | PDE4DPDE4APDE4BPDE4C | |
| SCHEMBL7792925 | 0.94 | PDE4D (0.44) | PDE4DPDE4APDE4BPDE4C | |
| SCHEMBL7802838 | 0.93 | PDE4D (0.43) | PDE4DPDE4APDE4BPDE4C | |
| SCHEMBL7792939 | 0.93 | PDE4D (0.43) | PDE4DPDE4APDE4BPDE4CCYP1A2 | |
| SCHEMBL7800553 | 0.93 | PDE4D (0.45) | PDE4DPDE4APDE4BPDE4C | |
| SCHEMBL8189801 | 0.92 | PDE4D (0.43) | PDE4DPDE4APDE4BPDE4C |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0723962-B1 | Arylalkyl-thiadiazinones | MERCK PATENT GMBH (DE) | 2001-07-04 | — | — | EP | disclosed |
| US-6025354-A | Arylalkyl-thiadiazinones | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2000-02-15 | — | — | US | disclosed |
| US-5747489-A | Arylalkyl-thiadiazinones | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-05-05 | — | — | US | disclosed |
| EP-0723962-A1 | Arylalkyl-thiadiazinones | MERCK PATENT GmbH (DE) | 1996-07-31 | — | — | EP | disclosed |