Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GNAI3 | P08754 | 1/20 | 0.57 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.57 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.57 |
| ▸ | PAOX | Q6QHF9 | 2/20 | 0.55 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.53 |
| ▸ | RRM1 | P23921 | 1/20 | 0.51 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.47 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.47 |
| ▸ | ALDH1A2 | O94788 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.43 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.43 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.41 |
| ▸ | TLR2 | O60603 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL15623802 | 0.98 | GNAI3 (0.60) | GNAI3GNAO1GNAI1PAOXDPP7 | |
| SCHEMBL8354456 | 0.94 | DPP7 (0.50) | GNAI3GNAO1GNAI1PAOXDPP7 | |
| SCHEMBL15623812 | 0.89 | ALDH1A2 (0.54) | GNAI3GNAO1GNAI1PAOXDPP7 | |
| SCHEMBL20922219 | 0.89 | PAOX (0.49) | GNAI3GNAO1GNAI1PAOXDPP7 | |
| SCHEMBL14357861 | 0.89 | PAOX (0.49) | GNAI3GNAO1GNAI1PAOXDPP7 | |
| SCHEMBL12085650 | 0.89 | PAOX (0.49) | GNAI3GNAO1GNAI1PAOXDPP7 | |
| SCHEMBL11650885 | 0.85 | PAOX (0.57) | GNAI3GNAO1GNAI1PAOXDPP7 | |
| SCHEMBL8352105 | 0.85 | — | — | |
| SCHEMBL4502659 | 0.85 | — | — | |
| SCHEMBL7700853 | 0.83 | DPP7 (0.67) | GNAI3GNAO1GNAI1DPP7RRM1 |
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-2003101382-A2 | COMPOUNDS USEFUL IN THE TREATMENT OF ANTHRAX AND INHIBITING LETHAL FACTOR | MERCK & CO., INC. (US) | 2003-12-11 | — | — | WO | disclosed |