Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 5/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.39 |
| ▸ | MAPK13 | O15264 | 2/20 | 0.33 |
| ▸ | MAPK12 | P53778 | 2/20 | 0.33 |
| ▸ | MAPK11 | Q15759 | 2/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.33 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.32 |
| ▸ | GABRP | O00591 | 2/20 | 0.31 |
| ▸ | GABRD | O14764 | 2/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.31 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.31 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.31 |
| ▸ | GABRE | P78334 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31207340 | 0.77 | ADORA1 (0.46) | ADORA1ADORA2ACA5AMAPK13MAPK12 | |
| SCHEMBL25475233 | 0.72 | ADORA1 (0.50) | ADORA1ADORA2ACA5AMAPK13MAPK12 | |
| SCHEMBL32683505 | 0.72 | ADORA1 (0.50) | ADORA1ADORA2ACA5AMAPK13MAPK12 | |
| SCHEMBL493663 | 0.70 | ADORA1 (0.41) | ADORA1ADORA2ACA5AGABRPGABRD | |
| SCHEMBL30554311 | 0.67 | MAPK13 (0.47) | ADORA1ADORA2ACA5AMAPK13MAPK12 | |
| SCHEMBL20916782 | 0.67 | MAPK13 (0.47) | ADORA1ADORA2ACA5AMAPK13MAPK12 | |
| SCHEMBL29768213 | 0.62 | PDPK1 (0.46) | ADORA1ADORA2APDPK1 | |
| SCHEMBL26675355 | 0.62 | PDPK1 (0.46) | ADORA1ADORA2APDPK1 | |
| SCHEMBL7425108 | 0.59 | PDPK1 (0.35) | PDPK1 | |
| SCHEMBL31032821 | 0.58 | CCR1 (0.41) | PDPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009117278-A2 | PROCESSES FOR PREPARING (AMINO-PYRAZOLOPYRIDINYL)METHOXY SUBSTITUTED BIARYL ETHERS | MERCK & CO., INC. (US) | 2009-09-24 | — | — | WO | disclosed |