Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.32 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | SCN1A | P35498 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.32 |
| ▸ | PARP14 | Q460N5 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29952387 | 0.86 | ALDH1A1 (0.41) | HRH3CA1CA2ENPP2ALDH1A1 | |
| SCHEMBL29956216 | 0.84 | ENPP2 (0.40) | ENPP2MAPK1ALDH1A1PARP14GAA | |
| SCHEMBL29953257 | 0.77 | AOC2 (0.37) | HRH3KCNH2CA1CA2ENPP2 | |
| SCHEMBL29957456 | 0.75 | ACACB (0.44) | CA1CA2ENPP2 | |
| SCHEMBL29954864 | 0.75 | KMT2A (0.42) | CA1CA2PARP14KMT2A | |
| SCHEMBL14167586 | 0.71 | CA2 (0.48) | CA1CA2ENPP2MAPK1ALDH1A1 | |
| SCHEMBL29953763 | 0.70 | ENPP2 (0.42) | ENPP2CYP1A2ALDH1A1MEN1KMT2A | |
| SCHEMBL1876565 | 0.70 | NPC1 (0.61) | HRH3KCNH2CA1CA2MAPK1 | |
| SCHEMBL16899329 | 0.69 | CA1 (0.42) | HRH3CA1CA2ENPP2 | |
| SCHEMBL20830808 | 0.69 | NFE2L2 (0.51) | HRH3CA1CA2ENPP2 |
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 |