Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 5/20 | 0.35 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | MAT2A | P31153 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.31 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | CTSS | P25774 | 1/20 | 0.30 |
| ▸ | CTSK | P43235 | 1/20 | 0.30 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27670874 | 0.93 | CDK1 (0.33) | TSHRPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL27670910 | 0.89 | FFAR2 (0.32) | CNR1FFAR2POLBMAT2AGRM1 | |
| SCHEMBL27650758 | 0.79 | AKR1B1 (0.36) | CNR1POLBHIF1AMAT2ATSHR | |
| SCHEMBL27670844 | 0.79 | NPC1 (0.34) | TSHRPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5446891 | 0.78 | CNR1 (0.38) | CNR1HIF1AMAT2ATSHRPDE4A | |
| SCHEMBL4516843 | 0.78 | SRC (0.41) | CNR1HIF1ATSHRPDE4APDE4B | |
| SCHEMBL5425818 | 0.77 | ALDH1A2 (0.38) | KDM4EALDH1A1 | |
| SCHEMBL27670851 | 0.75 | POLB (0.33) | CNR1POLBPDE4APDE4BPDE4C | |
| SCHEMBL4516830 | 0.73 | PDE4A (0.42) | CNR1HIF1AMAT2ATSHRPDE4A | |
| SCHEMBL4522660 | 0.73 | CDK1 (0.39) | CNR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1902201-A | Bicyclic pyrimidin-4-(3H)-ones and analogues and derivatives thereof which modulate the function of the vanilloid-1 receptor (VR1) | MERCK SHARP & DOHME (GB) | 2007-01-24 | — | — | CN | disclosed |