Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UPP1 | Q16831 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | DPYD | Q12882 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.31 |
| ▸ | EPAS1 | Q99814 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL3284250 | 0.78 | HAVCR2 (0.36) | UPP1MCL1DPYDKDM4E | |
| SCHEMBL3281908 | 0.73 | MAPK1 (0.34) | CYP2A6 | |
| SCHEMBL23660457 | 0.67 | CYP2A6 (0.47) | UPP1CYP2A6MCL1KDM4E | |
| SCHEMBL31537986 | 0.67 | CYP2A6 (0.47) | UPP1CYP2A6MCL1KDM4E | |
| SCHEMBL8163576 | 0.67 | CYP2A6 (0.38) | CYP2A6 | |
| SCHEMBL31515117 | 0.66 | CYP2A6 (0.42) | CYP2A6 | |
| SCHEMBL29957755 | 0.64 | — | — | |
| SCHEMBL10578445 | 0.62 | TDP1 (0.35) | KDM4E | |
| SCHEMBL16968397 | 0.62 | USP8 (0.35) | KDM4E | |
| SCHEMBL6898133 | 0.62 | VCAM1 (0.40) | EPAS1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |