Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28833008 | 0.77 | NAAA (0.40) | TSHR | |
| SCHEMBL6748930 | 0.70 | MEN1 (0.34) | TSHR | |
| SCHEMBL9977801 | 0.70 | MEN1 (0.32) | HPGDTSHRALDH1A1 | |
| SCHEMBL16409183 | 0.70 | CYP3A4 (0.39) | HPGDTSHRALDH1A1 | |
| SCHEMBL6748933 | 0.69 | MEN1 (0.33) | HPGDALDH1A1 | |
| SCHEMBL9977804 | 0.69 | MAPT (0.30) | — | |
| SCHEMBL27216297 | 0.68 | CYP3A4 (0.37) | HPGDTSHRALDH1A1 | |
| SCHEMBL11229001 | 0.68 | CYP3A4 (0.37) | HPGDTSHRALDH1A1 | |
| SCHEMBL16086201 | 0.63 | ALDH1A1 (0.48) | HPGDTSHRALDH1A1 | |
| SCHEMBL7067067 | 0.63 | CYP1A2 (0.34) | — |
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-2012083117-A1 | INHIBITORS OF INFLUENZA VIRUSES REPLICATION | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2012-06-21 | — | — | WO | disclosed |