Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.53 |
| ▸ | NOS1 | P29475 | 1/20 | 0.53 |
| ▸ | NOS2 | P35228 | 1/20 | 0.53 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | USP1 | O94782 | 1/20 | 0.42 |
| ▸ | USP8 | P40818 | 1/20 | 0.42 |
| ▸ | OTUB1 | Q96FW1 | 1/20 | 0.42 |
| ▸ | TTK | P33981 | 2/20 | 0.42 |
| ▸ | PDE3B | Q13370 | 4/20 | 0.41 |
| ▸ | PDE3A | Q14432 | 4/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 4/20 | 0.41 |
| ▸ | IGF1R | P08069 | 2/20 | 0.41 |
| ▸ | INSR | P06213 | 1/20 | 0.41 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.41 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | HTR1D | P28221 | 1/20 | 0.39 |
| ▸ | HTR1B | P28222 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL221344 | 0.89 | NOS1 (0.65) | NOS3NOS1NOS2CHEK1TTK | |
| SCHEMBL5134246 | 0.83 | NMT1 (0.43) | CHEK1IGF1R | |
| SCHEMBL221859 | 0.83 | NOS1 (0.57) | NOS3NOS1NOS2CHEK1TTK | |
| SCHEMBL5140700 | 0.81 | CHEK1 (0.47) | NOS3NOS1NOS2CHEK1TTK | |
| SCHEMBL424370 | 0.81 | NOS1 (0.54) | NOS3NOS1NOS2CHEK1 | |
| SCHEMBL27981858 | 0.78 | CHEK1 (0.45) | NOS3NOS1NOS2CHEK1PDE3B | |
| SCHEMBL1912083 | 0.77 | ALDH1A1 (0.50) | CHEK1PDE3BPDE3APDE10AHTR2C | |
| SCHEMBL10208091 | 0.77 | ALDH1A1 (0.50) | CHEK1PDE3BPDE3APDE10AHTR2C | |
| SCHEMBL1782598 | 0.77 | ALDH1A1 (0.50) | CHEK1PDE3BPDE3APDE10AHTR2C | |
| SCHEMBL16241883 | 0.77 | NOS1 (0.51) | NOS3NOS1NOS2CHEK1TTK |
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-1877054-A2 | NICOTINAMIDE RIBOSIDE AND ANALOGUES THEREOF | Sirtris Pharmaceuticals, Inc. (US) | 2008-01-16 | — | — | EP | disclosed |
| WO-2006105440-A2 | NICOTINAMIDE RIBOSIDE AND ANALOGUES THEREOF | SIRTRIS PHARMACEUTICALS, INC. (US) | 2006-10-05 | — | — | WO | disclosed |