Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.53 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29951577 | 0.91 | GAA (0.51) | CYP2C19KCNQ2KDM4EGAAHDAC3 | |
| SCHEMBL29952838 | 0.91 | HDAC3 (0.53) | KCNQ2KDM4EGAAHDAC3MEN1 | |
| SCHEMBL29955273 | 0.87 | KCNQ2 (0.56) | CYP2C19SMN1; SMN2KCNQ2POLBGAA | |
| SCHEMBL6934770 | 0.83 | CETP (0.61) | KCNQ2L3MBTL1KDM4EPOLBGAA | |
| SCHEMBL18248481 | 0.80 | CETP (0.63) | SMN1; SMN2KDM4EGAAHDAC3KMT2A | |
| SCHEMBL2555044 | 0.80 | KDM4E (0.50) | SMN1; SMN2KCNQ2KDM4EPOLBKMT2A | |
| SCHEMBL8779736 | 0.79 | KCNQ2 (0.50) | SMN1; SMN2KCNQ2KDM4EPOLBGAA | |
| SCHEMBL12523228 | 0.78 | CYP2C19 (0.60) | CYP2C19SMN1; SMN2SHMT2L3MBTL1KDM4E | |
| SCHEMBL28745628 | 0.78 | HDAC3 (0.66) | CYP2C19SMN1; SMN2KDM4EHDAC3MAPT | |
| SCHEMBL14292047 | 0.78 | HDAC3 (0.66) | CYP2C19SMN1; SMN2KDM4EHDAC3MAPT |
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 |