Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14844278 | 0.79 | HDAC4 (0.36) | LMNAL3MBTL1NPSR1ALDH1A1HTT | |
| SCHEMBL28738251 | 0.73 | HSD11B1 (0.50) | LMNAL3MBTL1ALDH1A1GAACHRM3 | |
| SCHEMBL14215419 | 0.73 | HDAC1 (0.36) | L3MBTL1NPSR1ALDH1A1GAAMAPK1 | |
| SCHEMBL2876825 | 0.71 | KCNA3 (0.45) | LMNAL3MBTL1NPSR1CHRM3HTT | |
| SCHEMBL1038462 | 0.71 | CHRM3 (0.60) | LMNAALDH1A1CHRM3HTTTSHR | |
| SCHEMBL30627103 | 0.70 | CYP3A4 (0.37) | LMNAL3MBTL1NPSR1ALDH1A1GAA | |
| SCHEMBL21044072 | 0.70 | HDAC1 (0.39) | NPSR1GAAHDAC4HRH3MAPK1 | |
| SCHEMBL22758534 | 0.70 | IDO1 (0.35) | LMNANPSR1ALDH1A1CHRM3HTT | |
| SCHEMBL1042365 | 0.69 | HDAC4 (0.62) | L3MBTL1ALDH1A1CHRM3POLBHTT | |
| SCHEMBL1038755 | 0.69 | HDAC4 (0.62) | L3MBTL1ALDH1A1CHRM3POLBHTT |
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-2571879-A1 | HETEROBIARYL-CYCLOHEXYL-TETRAAZABENZO[E]AZULENES | F.HOFFMANN-LA ROCHE AG (CH) | 2013-03-27 | — | — | EP | disclosed |
| WO-2011134877-A1 | HETEROBIARYL-CYCLOHEXYL-TETRAAZABENZO[E]AZULENES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-11-03 | — | — | WO | disclosed |