Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK2 | P49137 | 16/20 | 0.65 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.49 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.49 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.49 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.49 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.49 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | RAD52 | P43351 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4158374 | 0.88 | MAPKAPK2 (0.83) | MAPKAPK2ADRA2AADRA2BADRA2CRAD52 | |
| SCHEMBL5507688 | 0.86 | MAPKAPK2 (0.64) | MAPKAPK2ADRA2AADRA2BADRA2C | |
| SCHEMBL5511662 | 0.84 | MAPKAPK2 (0.78) | MAPKAPK2ADRA2AADRA2BADRA2CMITF | |
| SCHEMBL5508950 | 0.83 | MAPKAPK2 (0.59) | MAPKAPK2ADRA2AADRA2BADRA2CMITF | |
| SCHEMBL4141126 | 0.78 | MAPKAPK2 (0.96) | MAPKAPK2ADRA2AADRA2BADRA2CRAD52 | |
| SCHEMBL4149672 | 0.78 | MAPKAPK2 (1.00) | MAPKAPK2ADRA2AADRA2BADRA2CRAD52 | |
| SCHEMBL4153783 | 0.77 | MAPKAPK2 (1.00) | MAPKAPK2ADRA2AADRA2BADRA2CRAD52 | |
| SCHEMBL4155394 | 0.76 | MAPKAPK2 (0.76) | MAPKAPK2ADRA2AADRA2BADRA2CMITF | |
| SCHEMBL4146786 | 0.76 | MAPKAPK2 (0.81) | MAPKAPK2ADRA2AADRA2BADRA2CRAD52 | |
| SCHEMBL4147014 | 0.76 | MAPKAPK2 (1.00) | MAPKAPK2ADRA2AADRA2BADRA2CRAD52 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1781293-A1 | QUINOLINE- AND ISOQUINOLINE-BASED COMPOUNDS EXHIBITING ATP-UTILIZING ENZYME INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF | Amphora Discovery Corporation (US) | 2007-05-09 | — | — | EP | disclosed |
| WO-2005120509-A1 | QUINOLINE- AND ISOQUINOLINE-BASED COMPOUNDS EXHIBITING ATP-UTILIZING ENZYME INHIBITORY ACTIVITY, AND COMPOSITIONS, AND USES THEREOF | AMPHORA DISCOVERY CORPORATION (US) | 2005-12-22 | — | — | WO | disclosed |