Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 13/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 13/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 13/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 12/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 12/20 | 0.38 |
| ▸ | DRD2 | P14416 | 8/20 | 0.36 |
| ▸ | DRD4 | P21917 | 8/20 | 0.36 |
| ▸ | DRD3 | P35462 | 7/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.32 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4044981 | 0.94 | CHRM2 (0.36) | CHRM5CHRM1CHRM3CHRM2CHRM4 | |
| SCHEMBL3957672 | 0.93 | CYP1A2 (0.38) | CHRM5CHRM1CHRM3CHRM2CHRM4 | |
| SCHEMBL3950123 | 0.91 | ALDH1A1 (0.32) | ALDH1A1S1PR5 | |
| SCHEMBL3956154 | 0.87 | CYP1A2 (0.35) | CHRM5CHRM1CHRM3CHRM2CHRM4 | |
| SCHEMBL3950039 | 0.85 | ALDH1A1 (0.32) | ALDH1A1 | |
| SCHEMBL3949506 | 0.84 | ALDH1A1 (0.35) | CHRM5CHRM1CHRM3CHRM2CHRM4 | |
| SCHEMBL3950074 | 0.82 | ALDH1A1 (0.32) | ALDH1A1S1PR5GAA | |
| SCHEMBL3950772 | 0.82 | ALDH1A1 (0.36) | CHRM5CHRM1CHRM3CHRM2CHRM4 | |
| SCHEMBL3949683 | 0.80 | CHRM1 (0.33) | CHRM5CHRM1CHRM3CHRM2CHRM4 | |
| SCHEMBL3956741 | 0.79 | ALDH1A1 (0.39) | DRD2DRD3ALDH1A1CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009024825-A1 | 2-PYRAZINYLBENZIMIDAZOLE DERIVATIVES AS RECEPTOR TYROSINE KINASE INHIBITORS | ASTRAZENECA AB (SE) | 2009-02-26 | — | — | WO | disclosed |