Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | TDO2 | P48775 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | LPL | P06858 | 1/20 | 0.35 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.35 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.35 |
| ▸ | RORC | P51449 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL2840000 | 1.00 | IDO1 (0.39) | IDO1TDO2ACHEFFAR1FFAR4 | |
| SCHEMBL7478722 | 0.86 | ADORA3 (0.40) | IDO1TDO2ACHEFFAR1FFAR4 | |
| SCHEMBL29956290 | 0.83 | ALDH1A1 (0.49) | ACHECA2LPLLIPGALDH1A1 | |
| SCHEMBL29957865 | 0.82 | HDAC1 (0.36) | ACHE | |
| SCHEMBL29956860 | 0.81 | ACHE (0.32) | ACHECA2LPLLIPGALDH1A1 | |
| SCHEMBL16687417 | 0.81 | CA12 (0.36) | CA2CSNK2A1RORCALDH1A1IRAK4 | |
| SCHEMBL12537758 | 0.79 | TSHR (0.42) | ADORA3CSNK2A1RORCALDH1A1CYP3A4 | |
| SCHEMBL264985 | 0.79 | ACLY (0.39) | ACHECSNK2A1RORCALDH1A1IRAK4 | |
| SCHEMBL12775740 | 0.79 | TRPA1 (0.37) | ACHECSNK2A1RORCALDH1A1TRPA1 | |
| SCHEMBL29825745 | 0.78 | ACHE (0.58) | ACHECA2LPLLIPGALDH1A1 |
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 |