Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 7/20 | 0.46 |
| ▸ | ADORA2A | P29274 | 6/20 | 0.46 |
| ▸ | NQO2 | P16083 | 2/20 | 0.46 |
| ▸ | PIM1 | P11309 | 1/20 | 0.43 |
| ▸ | TDO2 | P48775 | 1/20 | 0.41 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.41 |
| ▸ | RAF1 | P04049 | 1/20 | 0.41 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.41 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.41 |
| ▸ | KMO | O15229 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MITF | O75030 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7997046 | 0.84 | MAPK11 (0.54) | ADORA2BADORA2APIM1MAPK13RAF1 | |
| SCHEMBL7997004 | 0.83 | MAPK14 (0.48) | ADORA2BADORA2ANQO2MAPK13MAPK12 | |
| SCHEMBL8000428 | 0.82 | MAPK14 (0.54) | ADORA2ATDO2MAPK13RAF1MAPK12 | |
| SCHEMBL30930875 | 0.71 | NUDT1 (0.40) | ADORA2BADORA2ANQO2MAPK13MAPK12 | |
| SCHEMBL30930949 | 0.70 | NUDT1 (0.42) | PIM1MAPK14KMO | |
| SCHEMBL15637672 | 0.68 | RORB (0.55) | ADORA2BADORA2APIM1TDO2MAPK13 | |
| SCHEMBL31472663 | 0.68 | NOTUM (0.48) | ADORA2BIDO1MAPTGRM5 | |
| SCHEMBL21333215 | 0.68 | NOTUM (0.48) | ADORA2BIDO1MAPTGRM5 | |
| SCHEMBL7993062 | 0.68 | MAPK14 (0.50) | ADORA2AMAPK13RAF1MAPK12MAPK11 | |
| SCHEMBL15637561 | 0.68 | GRM5 (0.52) | ADORA2APIM1TDO2ADORA1IDO1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001057018-A1 | AZAAZULENE INHIBITORS OF P38 MAP KINASE AND TNF-ALPHA | ABBOTT LABORATORIES (US) | 2001-08-09 | — | — | WO | claimed |
| WO-2001057018-A1 | AZAAZULENE INHIBITORS OF P38 MAP KINASE AND TNF-ALPHA | ABBOTT LABORATORIES (US) | 2001-08-09 | — | — | WO | disclosed |