Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.37 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SI | P14410 | 1/20 | 0.37 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.36 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.36 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.36 |
| ▸ | FPR2 | P25090 | 1/20 | 0.36 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9955506 | 0.85 | RAB9A (0.41) | NOTUMGAAMAOBNR4A2IDO1 | |
| SCHEMBL9955896 | 0.82 | NOTUM (0.39) | NOTUMPDE4BMGAMGAASI | |
| SCHEMBL5543913 | 0.80 | TRPM8 (0.43) | NOTUMPTGS2TRPM8PTGS1MGAM | |
| SCHEMBL5543906 | 0.77 | TRPM8 (0.41) | NOTUMPTGS2TRPM8PTGS1MGAM | |
| SCHEMBL1167044 | 0.75 | PIN1 (0.50) | TRPM8PDE4BNR4A1NR4A2NR4A3 | |
| SCHEMBL10263245 | 0.75 | TRPM8 (0.42) | NOTUMPTGS2TRPM8PTGS1MGAM | |
| SCHEMBL7624713 | 0.75 | PTGS2 (0.59) | PTGS2TRPM8PTGS1 | |
| SCHEMBL10263340 | 0.73 | L3MBTL1 (0.45) | TRPM8MGAMGAASIMGAM2 | |
| SCHEMBL31194857 | 0.73 | MAPK13 (0.60) | PTGS2PTGS1NR4A2 | |
| SCHEMBL9956374 | 0.73 | NOTUM (0.44) | NOTUMNR4A1NR4A2NR4A3IDO1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012085857-A1 | 3,8-DIAZA-BICYCLO[4.2.0]OCT-3-YL AMIDES | ACTELION PHARMACEUTICALS LTD (CH) | 2012-06-28 | — | — | WO | disclosed |