Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4A | O75164 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11180477 | 0.83 | ALDH1A1 (0.48) | KDM4AALDH1A1CYP3A4 | |
| Methane SCHEMBL10891751 | 0.81 | ALDH1A1 (0.46) | KDM4AALDH1A1CYP3A4 | |
| SCHEMBL503606 | 0.81 | ALDH1A1 (0.50) | KDM4AALDH1A1CYP3A4 | |
| SCHEMBL711225 | 0.81 | ALDH1A1 (0.50) | KDM4AALDH1A1CYP3A4 | |
| SCHEMBL7533460 | 0.79 | — | — | |
| SCHEMBL9420825 | 0.79 | ALDH1A1 (0.48) | KDM4AALDH1A1CYP3A4 | |
| Methane SCHEMBL1053204 | 0.79 | ALDH1A1 (0.48) | KDM4AALDH1A1CYP3A4 | |
| Water SCHEMBL5200164 | 0.79 | ALDH1A1 (0.48) | KDM4AALDH1A1CYP3A4 | |
| Selenium SCHEMBL11484547 | 0.79 | ALDH1A1 (0.48) | KDM4AALDH1A1CYP3A4 | |
| SCHEMBL29143167 | 0.79 | ALDH1A1 (0.48) | KDM4AALDH1A1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0839059-B1 | CARDIOTROPIC RADIOPHARMACEUTICALS COMPRISING A TRANSITION METAL NITRIDE COMPLEX AND HAVING RAPID MYOCARDIAL CLEARANCE | CIS BIO INT (FR) | 2002-04-17 | — | — | EP | claimed |