Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3825796 | 0.84 | MEN1 (0.31) | KDM4EPOLBTSHR | |
| SCHEMBL11202722 | 0.84 | IDO1 (0.38) | — | |
| SCHEMBL9180692 | 0.81 | CYP1A2 (0.33) | — | |
| SCHEMBL9182082 | 0.80 | TSHR (0.30) | TSHR | |
| SCHEMBL3825569 | 0.80 | TSHR (0.30) | TSHR | |
| SCHEMBL9181769 | 0.76 | LMNA (0.36) | ALDH1A1 | |
| SCHEMBL9185329 | 0.76 | AKR1B1 (0.41) | TDP1KDM4EL3MBTL1ALOX15ALDH1A1 | |
| SCHEMBL7455345 | 0.76 | MEN1 (0.37) | TDP1 | |
| SCHEMBL11200306 | 0.75 | ALDH1A1 (0.45) | KDM4EALDH1A1TSHR | |
| SCHEMBL14036889 | 0.75 | KDM4E (0.44) | TDP1KDM4EL3MBTL1ALOX15ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2099452-A2 | TRICARBONYL COMPLEXES WITH TRIDENTATE CHELATORS FOR MYOCARDIUM IMAGING | Mallinckrodt Inc. (US) | 2009-09-16 | — | — | EP | disclosed |
| WO-2008061792-A2 | TRICARBONYL COMPLEXES WITH TRIDENTATE CHELATORS FOR MYOCARDIUM IMAGING | MALLINCKRODT INC. (US) | 2008-05-29 | — | — | WO | disclosed |