Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8325718 | 0.85 | CYP2C19 (0.40) | PPARGPPARAADRA2BADRA2CSLC6A2 | |
| SCHEMBL8322987 | 0.83 | NPC1 (0.52) | NOS3NOS1NOS2PPARGPPARA | |
| SCHEMBL8324481 | 0.83 | NFE2L2 (0.45) | NFE2L2PPARGPPARASLC6A2SLC6A4 | |
| SCHEMBL8324438 | 0.81 | G6PC1 (0.48) | PPARGPPARASLC6A4ALDH1A1MAPT | |
| SCHEMBL8323270 | 0.80 | KDM4E (0.36) | NOS2PPARGPPARAADRA2BADRA2C | |
| SCHEMBL8326594 | 0.78 | NFE2L2 (0.44) | NOS3NOS1NOS2NFE2L2PPARG | |
| SCHEMBL8324682 | 0.75 | TP53 (0.40) | PPARGPPARAADRA2BADRA2CSLC6A2 | |
| SCHEMBL8324972 | 0.74 | TAAR1 (0.44) | NOS3NOS1NOS2NFE2L2PPARG | |
| SCHEMBL8326976 | 0.74 | MAOB (0.45) | ADRA2BADRA2CSLC6A2HTR2ASLC6A4 | |
| SCHEMBL8327755 | 0.74 | PNMT (0.41) | ALDH1A1TSHRRECQLGRIN1GRIN2B |
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-0948496-A2 | SUBSTITUTED PYRIMIDINONE AND PYRIDONE COMPOUNDS AND METHODS OF USE | Amgen inc. (US) | 1999-10-13 | — | — | EP | disclosed |
| WO-1998024780-A2 | SUBSTITUTED PYRIMIDINONE AND PYRIDINONE COMPOUNDS AND THEIR USE | AMGEN INC. (US) | 1998-06-11 | — | — | WO | disclosed |