Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL24878526 | 0.89 | CYP1A2 (0.36) | CYP1A2 | |
| SCHEMBL12090069 | 0.80 | CYP1A2 (0.52) | CYP1A2ADRA2ACHRNB4CHRNA3 | |
| SCHEMBL12985779 | 0.80 | CYP1A2 (0.52) | CYP1A2ADRA2ACHRNB4CHRNA3 | |
| SCHEMBL12089498 | 0.80 | CYP1A2 (0.52) | CYP1A2ADRA2ACHRNB4CHRNA3 | |
| SCHEMBL24837418 | 0.79 | CYP1A2 (0.52) | CYP1A2ADRA2A | |
| SCHEMBL21983391 | 0.77 | CYP1A2 (0.48) | CYP1A2ADRA2A | |
| SCHEMBL26921123 | 0.77 | CYP1A2 (0.48) | CYP1A2ADRA2A | |
| SCHEMBL21890124 | 0.77 | CYP1A2 (0.48) | CYP1A2ADRA2A | |
| SCHEMBL7269417 | 0.77 | CYP1A2 (0.48) | CYP1A2ADRA2A | |
| SCHEMBL21944473 | 0.76 | CYP1A2 (0.47) | CYP1A2ADRA2A |
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-1670769-A1 | BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEREOF AND USES THEREOF | AstraZeneca AB (SE) | 2006-06-21 | — | — | EP | disclosed |
| WO-2005030732-A1 | BENZIMIDAZOLE DERIVATIVES, COMPOSITIONS CONTAINING THEM, PREPARATION THEREOF AND USES THEREOF | ASTRAZENECA AB (SE) | 2005-04-07 | — | — | WO | disclosed |