Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 3/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.36 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.36 |
| ▸ | BRAF | P15056 | 1/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | SGK1 | O00141 | 2/20 | 0.34 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.34 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.34 |
| ▸ | CTSA | P10619 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2113611 | 0.85 | CNR1 (0.48) | CNR1PTGS2MAPTSCN5AKCNH2 | |
| SCHEMBL17866283 | 0.83 | CNR1 (0.47) | CNR1PTGS2MAPTSMN1; SMN2NPSR1 | |
| SCHEMBL2113588 | 0.83 | CNR1 (0.49) | CNR1PTGS2SMN1; SMN2SCN5AKCNH2 | |
| SCHEMBL17866255 | 0.82 | CNR1 (0.46) | CNR1PTGS2MAPTSMN1; SMN2NPSR1 | |
| SCHEMBL17866272 | 0.81 | MAPT (0.46) | CNR1PTGS2MAPTSMN1; SMN2NPSR1 | |
| SCHEMBL17866269 | 0.81 | KCNH2 (0.46) | CNR1PTGS2MAPTSMN1; SMN2NPSR1 | |
| SCHEMBL17866275 | 0.81 | CNR1 (0.45) | CNR1PTGS2MAPTSMN1; SMN2NPSR1 | |
| SCHEMBL2115870 | 0.81 | CNR1 (0.56) | CNR1PTGS2MAPTSMN1; SMN2SCN5A | |
| SCHEMBL17866284 | 0.81 | CNR1 (0.48) | CNR1PTGS2MAPTSMN1; SMN2NPSR1 | |
| SCHEMBL17866266 | 0.80 | MAPT (0.45) | CNR1PTGS2MAPTSMN1; SMN2NPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2627637-B1 | N-PYRIDIN-3-YL OR N-PYRAZIN-2-YL CARBOXAMIDES | HOFFMANN LA ROCHE (CH) | 2016-06-29 | — | — | EP | claimed |