Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | HTR2C | P28335 | 2/20 | 0.33 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2325644 | 1.00 | PTGS2 (0.36) | PTGS2KCNH2HTR2CMTNR1AMTNR1B | |
| SCHEMBL3120032 | 1.00 | PTGS2 (0.36) | PTGS2KCNH2HTR2CMTNR1AMTNR1B | |
| SCHEMBL2325719 | 0.90 | KCNH2 (0.46) | KCNH2 | |
| SCHEMBL2325713 | 0.90 | KCNH2 (0.46) | KCNH2 | |
| SCHEMBL3721902 | 0.81 | KCNH2 (0.36) | KCNH2 | |
| SCHEMBL2360997 | 0.81 | KCNH2 (0.36) | KCNH2 | |
| SCHEMBL3111386 | 0.81 | KCNH2 (0.36) | KCNH2 | |
| SCHEMBL3721907 | 0.81 | KCNH2 (0.36) | KCNH2 | |
| SCHEMBL2505369 | 0.81 | KCNH2 (0.44) | KCNH2 | |
| SCHEMBL3106240 | 0.80 | NNMT (0.30) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2167494-B1 | 3-AMINO-6-(1-AMINO-ETHYL)-TETRAHYDROPYRAN DERIVATIVES | ACTELION PHARMACEUTICALS LTD (CH) | 2011-08-17 | — | — | EP | disclosed |