Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 2/20 | 0.60 |
| ▸ | PIM1 | P11309 | 2/20 | 0.49 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.49 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.49 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.42 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.40 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.40 |
| ▸ | HTR1D | P28221 | 7/20 | 0.40 |
| ▸ | HTR1B | P28222 | 6/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 2/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7493529 | 0.85 | CYP2A6 (0.58) | CYP2A6PIM1PIM3IMPDH2GPR84 | |
| SCHEMBL7490083 | 0.85 | CYP2A6 (0.63) | CYP2A6PIM1PIM3IMPDH2GPR84 | |
| SCHEMBL3260214 | 0.85 | CYP2A6 (0.51) | CYP2A6PIM1PIM3IMPDH2GPR84 | |
| SCHEMBL7496069 | 0.82 | CYP1A2 (0.57) | CYP2A6IMPDH2GPR84HTR1DHTR1B | |
| SCHEMBL29952428 | 0.80 | CYP2A6 (0.70) | CYP2A6PIM1PIM3IMPDH2TRIM24 | |
| SCHEMBL31428911 | 0.79 | CYP2A6 (0.49) | CYP2A6PIM1PIM3IMPDH2HTR2A | |
| SCHEMBL2309341 | 0.79 | CYP2A6 (0.64) | CYP2A6PIM1PIM3IMPDH2GPR84 | |
| SCHEMBL29954717 | 0.79 | CYP2A6 (0.64) | CYP2A6PIM1PIM3IMPDH2GPR84 | |
| SCHEMBL7834285 | 0.79 | CYP2A6 (0.51) | CYP2A6PIM1PIM3IMPDH2GPR84 | |
| SCHEMBL29950589 | 0.78 | CYP2A6 (0.54) | CYP2A6IMPDH2HTR1DHTR1BHTR2A |
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 |