Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | PRCP | P42785 | 1/20 | 0.48 |
| ▸ | BRD4 | O60885 | 1/20 | 0.47 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.46 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.46 |
| ▸ | BCL2 | P10415 | 1/20 | 0.43 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.43 |
| ▸ | BAK1 | Q16611 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2651517 | 0.85 | GAA (0.58) | GAAHPGDSMN1; SMN2ALDH1A1PRCP | |
| SCHEMBL7674958 | 0.85 | GAA (0.58) | GAAHPGDSMN1; SMN2ALDH1A1PRCP | |
| SCHEMBL2651519 | 0.85 | GAA (0.58) | GAAHPGDSMN1; SMN2ALDH1A1PRCP | |
| SCHEMBL10315770 | 0.83 | L3MBTL1 (0.45) | HPGDALDH1A1GPR139 | |
| SCHEMBL8300135 | 0.81 | HTT (0.58) | ALDH1A1MEN1KMT2A | |
| SCHEMBL8300122 | 0.81 | HSD17B10 (0.58) | HPGDALDH1A1MEN1KMT2A | |
| SCHEMBL12707460 | 0.81 | HSD17B10 (0.58) | HPGDALDH1A1MEN1KMT2A | |
| SCHEMBL22279548 | 0.81 | GAA (0.58) | GAAHPGDSMN1; SMN2ALDH1A1PRCP | |
| SCHEMBL12291882 | 0.81 | HSD17B10 (0.58) | HPGDALDH1A1MEN1KMT2A | |
| SCHEMBL6392377 | 0.81 | GAA (0.58) | GAAHPGDSMN1; SMN2ALDH1A1PRCP |
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-2573083-A1 | Inhibitors of serine proteases, particularly HCV NS3-NS4A protease | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2013-03-27 | — | — | EP | disclosed |
| WO-2005035525-A2 | 2-AMIDO-4-ARYLOXY-1-CARBONYLPYRROLIDINE DERIVATIVES AS INHIBITORS OF SERINE PROTEASES, PARTICULARLY HCV NS3-NS4A PROTEASE | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2005-04-21 | — | — | WO | disclosed |