Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
| ▸ | PLEC | Q15149 | 1/20 | 0.41 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | GABRP | O00591 | 3/20 | 0.39 |
| ▸ | GABRD | O14764 | 3/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 3/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 3/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 3/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 3/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 3/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 3/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23767845 | 0.83 | MAPK1 (0.45) | MAPK1KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL19659161 | 0.79 | MAPK1 (0.40) | MAPK1KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL1336127 | 0.79 | MAPK1 (0.55) | MAPK1KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL30041829 | 0.79 | MAPK1 (0.55) | MAPK1KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL22391615 | 0.78 | CHEK1 (0.39) | MAPK1KDM4EALDH1A1HPGDHTT | |
| SCHEMBL4807973 | 0.76 | MAPK1 (0.47) | MAPK1KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL3838713 | 0.74 | EGFR (0.38) | KDM4EALDH1A1MAPTHPGDGAA | |
| SCHEMBL3426096 | 0.74 | MAPK1 (0.46) | MAPK1KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL29260500 | 0.74 | MAPK1 (0.46) | MAPK1KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL17205357 | 0.73 | KDM4E (0.46) | MAPK1KDM4EALDH1A1MAPTHPGD |
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-2661428-B1 | QUINOXALINES AND AZA-QUINOXALINES AS CRTH2 RECEPTOR MODULATORS | MERCK SHARP & DOHME (US) | 2017-06-07 | — | — | EP | disclosed |