Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.46 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.46 |
| ▸ | RAF1 | P04049 | 1/20 | 0.46 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.46 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.46 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.46 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.45 |
| ▸ | GRM5 | P41594 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.42 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.42 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.42 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | TDO2 | P48775 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL30239600 | 0.86 | MAPK14 (0.49) | KDM1AMAPK13RAF1MAPK12MAPK11 | |
| SCHEMBL218119 | 0.84 | ALOX15 (0.52) | ERBB2GRM5IDO1NPC1RAB9A | |
| SCHEMBL24963519 | 0.79 | AURKA (0.45) | MAOBMAPK13RAF1MAPK12MAPK11 | |
| SCHEMBL28329372 | 0.77 | ADORA1 (0.49) | MAPK13MAPK12MAPK11MAPK14ADORA1 | |
| SCHEMBL1128951 | 0.77 | ALDH1A1 (0.50) | MAPK13MAPK12MAPK11MAPK14ERBB2 | |
| SCHEMBL1129154 | 0.77 | ALDH1A1 (0.50) | MAPK13MAPK12MAPK11MAPK14ERBB2 | |
| SCHEMBL3108967 | 0.77 | TDP1 (0.52) | NPC1RAB9AADORA1 | |
| SCHEMBL28197453 | 0.76 | ALOX15 (0.43) | GRM5IDO1RAB9AADORA1 | |
| SCHEMBL1847072 | 0.76 | CLK4 (0.45) | MAOBMAPK14GRM5CYP11B2TDO2 | |
| SCHEMBL27844934 | 0.76 | ERBB2 (0.41) | MAOBKDM1AMAPK13RAF1MAPK12 |
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-2009151991-A1 | PYRAZOLE DERIVATIVES USEFUL AS INHIBITORS OF FAAH | MERCK & CO., INC. (US) | 2009-12-17 | — | — | WO | disclosed |