Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1B | P35368 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | PKM | P14618 | 3/20 | 0.48 |
| ▸ | PKLR | P30613 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 4/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | TOP2A | P11388 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 1/20 | 0.42 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.42 |
| ▸ | SALL4 | Q9UJQ4 | 1/20 | 0.42 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.42 |
| ▸ | BACE1 | P56817 | 6/20 | 0.40 |
| ▸ | BACE2 | Q9Y5Z0 | 6/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5129281 | 0.99 | ADRA1B (0.47) | ADRA1BMAPTPKMPKLRSMN1; SMN2 | |
| SCHEMBL5315271 | 0.88 | BRD4 (0.44) | ADRA1BMAPTPKMPKLRSMN1; SMN2 | |
| SCHEMBL5118071 | 0.87 | ADRA1B (0.51) | ADRA1BMAPTPKMPKLRSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL5127004 | 0.87 | BRD4 (0.44) | ADRA1BMAPTPKMPKLRSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL5116906 | 0.87 | ADRA1B (0.50) | ADRA1BMAPTPKMPKLRSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL5127777 | 0.87 | ADRA1B (0.50) | ADRA1BMAPTPKMPKLRSMN1; SMN2 | |
| SCHEMBL5263543 | 0.83 | ADRA1B (0.53) | ADRA1BMAPTPKMPKLRSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL5121300 | 0.83 | ADRA1B (0.50) | ADRA1BMAPTPKMPKLRSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL5129005 | 0.82 | ADRA1B (0.52) | ADRA1BMAPTPKMPKLRSMN1; SMN2 | |
| SCHEMBL5128705 | 0.82 | PKM (0.55) | ADRA1BMAPTPKMPKLRSMN1; SMN2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1791840-A1 | SUBSTITUTED BICYCLIC IMIDAZO-3-YLAMINE COMPOUNDS | Grünenthal GmbH (DE) | 2007-06-06 | — | — | EP | disclosed |
| WO-2006029980-A1 | SUBSTITUTED BICYCLIC IMIDAZO-3-YLAMINE COMPOUNDS | Grünenthal GmbH (DE) | 2006-03-23 | — | — | WO | disclosed |