Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 1/20 | 0.47 |
| ▸ | TLR2 | O60603 | 1/20 | 0.47 |
| ▸ | EGFR | P00533 | 7/20 | 0.46 |
| ▸ | GAK | O14976 | 3/20 | 0.46 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | KDR | P35968 | 3/20 | 0.45 |
| ▸ | IDO1 | P14902 | 3/20 | 0.45 |
| ▸ | TDO2 | P48775 | 3/20 | 0.44 |
| ▸ | FLT3 | P36888 | 1/20 | 0.43 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.43 |
| ▸ | MERTK | Q12866 | 1/20 | 0.43 |
| ▸ | GAS6 | Q14393 | 1/20 | 0.43 |
| ▸ | FBP1 | P09467 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL10289572 | 0.84 | GRM4 (0.57) | TLR4TLR2ABCG2KDRALDH1A1 | |
| SCHEMBL12262248 | 0.80 | EGFR (0.52) | EGFRGAKABCG2MEN1MAPK10 | |
| SCHEMBL8189003 | 0.77 | ALDH1A1 (0.60) | EGFRGAKABCG2MEN1GFER | |
| SCHEMBL15522255 | 0.76 | ROCK1 (0.49) | EGFRGAKABCG2KDRIDO1 | |
| SCHEMBL30213680 | 0.76 | ROCK1 (0.49) | EGFRGAKABCG2KDRIDO1 | |
| SCHEMBL26545887 | 0.75 | IDO1 (0.47) | EGFRGAKABCG2MEN1KMT2A | |
| SCHEMBL1062981 | 0.75 | MEN1 (0.50) | TLR4TLR2EGFRABCG2MEN1 | |
| SCHEMBL8471004 | 0.75 | EGFR (0.53) | TLR4TLR2EGFRABCG2MEN1 | |
| SCHEMBL6837492 | 0.75 | RAB9A (0.63) | TLR4TLR2EGFRMEN1MAPK10 | |
| SCHEMBL10139167 | 0.75 | MEN1 (0.58) | TLR4TLR2EGFRMEN1MAPK10 |
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-1863818-B1 | ACETYLENYL-PYRAZOLO-PVRIMIDINE DERIVATIVES AS MGLUR2 ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2010-03-10 | — | — | EP | disclosed |