Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | KMO | O15229 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25044253 | 0.78 | NOS1 (0.34) | NOS1KMOMAPTHTR2AHTR2C | |
| SCHEMBL27978870 | 0.76 | NOS1 (0.33) | NOS1MAPTHTR2AHTR2CHTR2B | |
| SCHEMBL2144057 | 0.76 | NOTUM (0.44) | KMOHTR2AHTR2CHTR2B | |
| SCHEMBL31172027 | 0.76 | NOTUM (0.44) | KMOHTR2AHTR2CHTR2B | |
| SCHEMBL27978876 | 0.76 | HTR2A (0.49) | MAPTHTR2AHTR2C | |
| SCHEMBL31126171 | 0.76 | KMO (0.47) | KMOMAPTHTR2AHTR2C | |
| SCHEMBL6741169 | 0.72 | KMO (0.41) | NOS1KMOMAPTHTR2AHTR2C | |
| SCHEMBL12930779 | 0.71 | RECQL (0.66) | KMORECQL | |
| SCHEMBL30373967 | 0.70 | RECQL (0.52) | KMOMAPTRECQL | |
| SCHEMBL3535213 | 0.70 | RECQL (0.52) | KMOMAPTRECQL |
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-104024258-A | Pyrrolopyrazine kinase inhibitors | HOFFMANN LA ROCHE | 2014-09-03 | — | — | CN | disclosed |