Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | PYGL | P06737 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.33 |
| ▸ | RELA | Q04206 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | DPP4 | P27487 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | CCR5 | P51681 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4735762 | 0.98 | ALDH1A1 (0.38) | ALDH1A1PYGLEPHX1L3MBTL1 | |
| SCHEMBL8007229 | 0.85 | ALDH1A1 (0.35) | ALDH1A1EPHX1L3MBTL1 | |
| SCHEMBL992260 | 0.84 | — | — | |
| SCHEMBL27510109 | 0.83 | EPHX1 (0.39) | EPHX1DPP4 | |
| SCHEMBL6476990 | 0.83 | — | — | |
| SCHEMBL5965337 | 0.83 | — | — | |
| SCHEMBL4052855 | 0.83 | HSD11B1 (0.34) | EPHX1DPP4 | |
| SCHEMBL583649 | 0.83 | — | — | |
| SCHEMBL14095485 | 0.82 | ALDH1A1 (0.41) | ALDH1A1PYGLNFKB1NFKB2RELA | |
| SCHEMBL7025316 | 0.81 | EPHX2 (0.36) | ALDH1A1EPHX1 |
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-2008074035-A1 | HCV PROTEASE INHIBITORS AND USES THEREOF | ABBOTT LABORATORIES (US) | 2008-06-19 | — | — | WO | disclosed |