Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.45 |
| ▸ | PDE4A | P27815 | 1/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
| ▸ | ENPP2 | Q13822 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | FPR2 | P25090 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.38 |
| ▸ | XDH | P47989 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1156315 | 0.92 | ALDH1A1 (0.54) | ALDH1A1GAAPDE4BPDE4APDE4C | |
| SCHEMBL2558072 | 0.82 | ALDH1A1 (0.44) | ALDH1A1GAAENPP2CA2CYP1A2 | |
| SCHEMBL1963060 | 0.81 | PDE4A (0.50) | ALDH1A1GAAPDE4BPDE4APDE4C | |
| SCHEMBL29956752 | 0.81 | ENPP2 (0.43) | ALDH1A1GAAENPP2LMNAMAPT | |
| SCHEMBL23114 | 0.80 | ENPP2 (0.52) | ALDH1A1ENPP2CA1CA2CYP1A2 | |
| SCHEMBL29955098 | 0.80 | ENPP2 (0.44) | PDE4BPDE4APDE4CPDE4DENPP2 | |
| SCHEMBL29950801 | 0.79 | HSD17B10 (0.44) | ALDH1A1GAAPDE4BPDE4APDE4D | |
| SCHEMBL7420999 | 0.79 | HSD17B10 (0.44) | ALDH1A1GAAPDE4BPDE4APDE4D | |
| SCHEMBL15489211 | 0.78 | MAOB (0.50) | ALDH1A1GAAPDE4BPDE4APDE4C | |
| SCHEMBL5636990 | 0.78 | ENPP2 (0.42) | PDE4BPDE4APDE4CPDE4DENPP2 |
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 |