Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK8 | P45983 | 2/20 | 0.41 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 4/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.35 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.35 |
| ▸ | WDR5 | P61964 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 2/20 | 0.34 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4763233 | 0.88 | GRM2 (0.48) | MAPK8GRM2KCNA5JAK2 | |
| SCHEMBL1654700 | 0.78 | KDM4A (0.42) | GRM2EPHX2KCNA5 | |
| SCHEMBL4770917 | 0.78 | KCNA5 (0.44) | GRM2EPHX2KCNA5DDR1PDE10A | |
| SCHEMBL4762143 | 0.77 | KDM4A (0.41) | GRM2EPHX2KCNA5 | |
| SCHEMBL10012827 | 0.77 | TSHR (0.43) | GRM2EPHX2KCNA5PPARG | |
| SCHEMBL2522396 | 0.76 | KCNA5 (0.42) | GRM2EPHX2KCNA5DDR1PDE10A | |
| SCHEMBL7257857 | 0.76 | KCNA5 (0.47) | GRM2EPHX2KCNA5PDE10A | |
| SCHEMBL4762246 | 0.75 | KDM4A (0.40) | GRM2RIPK1EPHX2KCNA5 | |
| SCHEMBL4769004 | 0.74 | KCNA5 (0.46) | GRM2EPHX2KCNA5ANO1 | |
| SCHEMBL32665476 | 0.74 | NQO2 (0.48) | GRM2KCNA5 |
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-1496836-B1 | N-(SUBSTITUTED BENZYL)-8-HYDROXY-1,6-NAPHTHYRIDINE-7- CARBOXAMIDES USEFUL AS HIV INTEGRASE INHIBITORS | MERCK & CO INC (US) | 2008-09-24 | — | — | EP | disclosed |