Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.42 |
| ▸ | NOS1 | P29475 | 1/20 | 0.42 |
| ▸ | NOS2 | P35228 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | CRHBP | P24387 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.31 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.30 |
| ▸ | HTR2B | P41595 | 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 | |
|---|---|---|---|---|
| SCHEMBL13790110 | 0.83 | NOS3 (0.50) | NOS3NOS1NOS2CYP3A4CYP2D6 | |
| SCHEMBL30328386 | 0.80 | KDM4E (0.33) | L3MBTL1LMNA | |
| SCHEMBL29236605 | 0.80 | KDM4E (0.33) | L3MBTL1LMNA | |
| SCHEMBL1706014 | 0.79 | NOS3 (0.39) | NOS3NOS1NOS2CYP3A4CYP2D6 | |
| SCHEMBL9228677 | 0.77 | NOS2 (0.57) | NOS3NOS1NOS2CYP3A4CYP2D6 | |
| SCHEMBL125608 | 0.77 | — | — | |
| SCHEMBL20840548 | 0.77 | ALDH1A1 (0.30) | L3MBTL1 | |
| SCHEMBL799308 | 0.76 | NOS3 (0.45) | NOS3NOS1NOS2CYP3A4CYP2D6 | |
| SCHEMBL1706178 | 0.76 | NOS3 (0.36) | NOS3NOS1NOS2CYP3A4CYP2D6 | |
| SCHEMBL5746657 | 0.76 | HRH3 (0.46) | NOS3NOS1NOS2HTR2B |
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 |
|---|---|---|---|---|---|---|---|
| US-4163848-A | Process for the production of 2-alkyl- or cycloalkyl-4-methyl-6-hydroxypyrimidines | CIBA-GEIGY CORPORATION (US) | 1979-08-07 | — | — | US | disclosed |