Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 2/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.34 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.32 |
| ▸ | BUB1 | O43683 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.31 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.31 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.30 |
| ▸ | DHODH | Q02127 | 1/20 | 0.30 |
| ▸ | DTYMK | P23919 | 1/20 | 0.30 |
| ▸ | BRD4 | O60885 | 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 | |
|---|---|---|---|---|
| SCHEMBL31526050 | 0.82 | PDE5A (0.41) | PDE5ABCHENOTUMESR2NR1H2 | |
| SCHEMBL17022464 | 0.82 | PDE5A (0.41) | PDE5ABCHENOTUMESR2NR1H2 | |
| SCHEMBL26647342 | 0.82 | PDE5A (0.41) | PDE5ABCHENOTUMESR2SRD5A1 | |
| SCHEMBL2673664 | 0.82 | PDE5A (0.41) | PDE5ABCHENOTUMESR2MAPT | |
| SCHEMBL2267569 | 0.81 | NOTUM (0.43) | PDE5ABCHENOTUMKDM4E | |
| SCHEMBL2419240 | 0.78 | NOTUM (0.62) | PDE5ABCHENOTUMKDM4EMAPT | |
| SCHEMBL29541811 | 0.78 | NOTUM (0.62) | PDE5ABCHENOTUMKDM4EMAPT | |
| SCHEMBL16830137 | 0.78 | ALDH1A1 (0.47) | KDM4EMAPT | |
| SCHEMBL29958326 | 0.75 | GPR119 (0.46) | NOTUMESR2NR1H2KDM4EGPR119 | |
| SCHEMBL7491697 | 0.75 | GPR119 (0.46) | NOTUMESR2NR1H2KDM4EGPR119 |
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 |