Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.37 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.37 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.35 |
| ▸ | ERN1 | O75460 | 4/20 | 0.34 |
| ▸ | PIM1 | P11309 | 3/20 | 0.33 |
| ▸ | PIM3 | Q86V86 | 3/20 | 0.33 |
| ▸ | PIM2 | Q9P1W9 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.33 |
| ▸ | HTR1D | P28221 | 3/20 | 0.33 |
| ▸ | HTR1B | P28222 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29957429 | 0.86 | CYP2A6 (0.37) | CYP2A6TRIM24TRIM33TDP1ERN1 | |
| SCHEMBL3034999 | 0.86 | CYP2A6 (0.37) | CYP2A6TRIM24TRIM33TDP1ERN1 | |
| SCHEMBL671586 | 0.85 | CYP2A6 (0.41) | CYP2A6TRIM24TRIM33TDP1PIM1 | |
| SCHEMBL29953960 | 0.85 | CYP2A6 (0.41) | CYP2A6TRIM24TRIM33ERN1PIM1 | |
| SCHEMBL29956106 | 0.85 | CYP2A6 (0.41) | CYP2A6TRIM24TRIM33TDP1PIM1 | |
| SCHEMBL2532843 | 0.85 | CYP2A6 (0.41) | CYP2A6TRIM24TRIM33ERN1PIM1 | |
| SCHEMBL12152010 | 0.79 | TRIM24 (0.51) | CYP2A6TRIM24TRIM33ADRA2ACLCN2 | |
| SCHEMBL671969 | 0.79 | TRIM24 (0.47) | CYP2A6TRIM24TRIM33TDP1ADRA2A | |
| SCHEMBL12152064 | 0.79 | CYP2A6 (0.37) | CYP2A6TRIM24TRIM33ERN1PIM1 | |
| SCHEMBL12151973 | 0.79 | CYP2A6 (0.47) | CYP2A6TRIM24TRIM33ERN1PIM1 |
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 |