Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 11/20 | 0.75 |
| ▸ | CYP2C9 | P11712 | 10/20 | 0.75 |
| ▸ | CYP3A4 | P08684 | 9/20 | 0.75 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.75 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.75 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.75 |
| ▸ | CA1 | P00915 | 2/20 | 0.60 |
| ▸ | CA2 | P00918 | 2/20 | 0.60 |
| ▸ | CA9 | Q16790 | 2/20 | 0.60 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.53 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.53 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.53 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.53 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.53 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.53 |
| ▸ | PORCN | Q9H237 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9451421 | 0.92 | CYP2D6 (0.72) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL14129854 | 0.86 | CYP2D6 (1.00) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL9471631 | 0.86 | CYP2D6 (0.77) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL8795724 | 0.84 | CYP2D6 (0.75) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL8488413 | 0.84 | CYP2D6 (0.75) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL8483819 | 0.83 | CYP2D6 (0.73) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL8794635 | 0.83 | CYP2D6 (0.73) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL5202195 | 0.83 | CYP2D6 (0.72) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL6573617 | 0.83 | CYP2D6 (0.72) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 | |
| SCHEMBL11449452 | 0.82 | CYP2D6 (0.68) | CYP2D6CYP2C9CYP3A4CYP1A2CYP2C19 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1144805-C | Bispidine compounds useful in treatment of cardiac arrhythmias | — | 2004-04-07 | — | — | CN | disclosed |
| US-5273993-A | Antiarthritic agents; osteoporosis | A. H. ROBINS COMPANY, INCORPORATED (US) | 1993-12-28 | — | — | US | disclosed |
| US-5194446-A | Antiarthritic agents | A. H. ROBINS COMPANY, INCORPORATED (US) | 1993-03-16 | — | — | US | disclosed |
| US-5192785-A | Sulfamates as antiglaucoma agents | A. H. ROBINS COMPANY, INCORPORATED (US) | 1993-03-09 | — | — | US | disclosed |
| US-5025031-A | Aryl and aryloxyalkyl sulfamate esters useful as anticonvulsants | A. H. ROBINS CO., INC. (US) | 1991-06-18 | — | — | US | disclosed |
| EP-0403185-A2 | Compounds having one or more aminosulfonyloxy radicals useful as pharmaceuticals | A.H. ROBINS COMPANY, INCORPORATED (US) | 1990-12-19 | — | — | EP | disclosed |