Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 20/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.50 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.49 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | FPR1 | P21462 | 1/20 | 0.48 |
| ▸ | TACR3 | P29371 | 1/20 | 0.48 |
| ▸ | GPR183 | P32249 | 1/20 | 0.48 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.48 |
| ▸ | GPR65 | Q8IYL9 | 1/20 | 0.48 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5412788 | 1.00 | TACR1 (0.56) | TACR1KCNH2NR1I2NR3C1CYP3A4 | |
| SCHEMBL6435565 | 1.00 | TACR1 (0.56) | TACR1KCNH2NR1I2NR3C1CYP3A4 | |
| SCHEMBL4693187 | 1.00 | TACR1 (0.56) | TACR1KCNH2NR1I2NR3C1CYP3A4 | |
| SCHEMBL5412707 | 1.00 | TACR1 (0.56) | TACR1KCNH2NR1I2NR3C1CYP3A4 | |
| SCHEMBL5413408 | 1.00 | TACR1 (0.56) | TACR1KCNH2NR1I2NR3C1CYP3A4 | |
| SCHEMBL6990518 | 0.91 | TACR1 (0.47) | TACR1 | |
| SCHEMBL6990250 | 0.91 | TACR1 (0.47) | TACR1 | |
| SCHEMBL6994101 | 0.91 | TACR1 (0.47) | TACR1 | |
| SCHEMBL7550074 | 0.90 | TACR1 (0.45) | TACR1KCNH2NR1I2NR3C1CYP3A4 | |
| SCHEMBL7547903 | 0.90 | TACR1 (0.45) | TACR1KCNH2NR1I2NR3C1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1427723-A1 | TETRAHYDROPYRAN DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS | MERCK SHARP & DOHME LTD. (GB) | 2004-06-16 | — | — | EP | disclosed |
| WO-2003022839-A1 | TETRAHYDROPYRAN DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS | MERCK SHARP & DOHME LIMITED (GB) | 2003-03-20 | — | — | WO | disclosed |