Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.33 |
| ▸ | CA1 | P00915 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | FDPS | P14324 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL25785871 | 0.90 | CA1 (0.32) | CA2CA1FDPS | |
| SCHEMBL11990783 | 0.86 | FDPS (0.38) | CA2TSHRFDPS | |
| SCHEMBL14048722 | 0.86 | FDPS (0.38) | CA2TSHRFDPS | |
| SCHEMBL1024157 | 0.81 | CA2 (0.35) | CA2CA1ALDH1A1CYP3A4TSHR | |
| SCHEMBL796692 | 0.76 | CA2 (0.38) | CA2CA1ALDH1A1CYP3A4TSHR | |
| SCHEMBL11496837 | 0.73 | CA2 (0.42) | CA2CA1ALDH1A1CYP3A4TSHR | |
| SCHEMBL17607693 | 0.72 | CA2 (0.35) | CA2CA1ALDH1A1CYP3A4TSHR | |
| SCHEMBL29163123 | 0.68 | FDPS (0.42) | CA2ALDH1A1TSHRFDPS | |
| SCHEMBL13918258 | 0.68 | FDPS (0.36) | CA2FDPS | |
| SCHEMBL11806750 | 0.67 | CA2 (0.41) | CA2CA1ALDH1A1CYP3A4TSHR |
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-3567029-A1 | COMPOSITIONS, METHODS, AND SYSTEMS FOR THE SYNTHESIS AND USE OF IMAGING AGENTS | Lantheus Medical Imaging, Inc. (US) | 2019-11-13 | — | — | EP | disclosed |