Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MPO | P05164 | 2/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | KDM5A | P29375 | 1/20 | 0.59 |
| ▸ | BLM | P54132 | 1/20 | 0.59 |
| ▸ | GFER | P55789 | 1/20 | 0.59 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.59 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | OGG1 | O15527 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.56 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.56 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.54 |
| ▸ | BAD | Q92934 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL72425 | 0.93 | MPO (0.67) | MPOCYP3A4KDM5ABLMGFER | |
| SCHEMBL752600 | 0.91 | MPO (0.70) | MPOCYP3A4KDM5ABLMGFER | |
| Terephthalic Acid SCHEMBL11861447 | 0.87 | TSHR (0.61) | MPOCYP3A4KDM5ABLMGFER | |
| SCHEMBL1706875 | 0.87 | NPC1 (0.67) | MPOCYP3A4KDM5ABLMGFER | |
| Hydrochloric Acid SCHEMBL5804936 | 0.85 | NPC1 (0.64) | MPOCYP3A4KDM5ABLMGFER | |
| SCHEMBL17044693 | 0.84 | MPO (0.61) | MPOCYP3A4KDM5ABLMGFER | |
| SCHEMBL2678949 | 0.83 | MPO (0.80) | MPOCYP3A4KDM5ABLMGFER | |
| SCHEMBL343630 | 0.83 | MPO (0.80) | MPOCYP3A4KDM5ABLMGFER | |
| SCHEMBL5480869 | 0.83 | MPO (0.87) | MPOCYP3A4KDM5ABLMGFER | |
| SCHEMBL2834402 | 0.82 | MITF (0.68) | MPOCYP3A4KDM5ABLMGFER |
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-1994009773-A1 | NEW ANTIVIRAL AGENTS | THE SCRIPPS RESEARCH INSTITUTE (US) | 1994-05-11 | — | — | WO | disclosed |