Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN1A | P35498 | 5/20 | 0.66 |
| ▸ | SCN5A | Q14524 | 5/20 | 0.66 |
| ▸ | SCN9A | Q15858 | 5/20 | 0.66 |
| ▸ | PLD1 | Q13393 | 3/20 | 0.55 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
| ▸ | CCR1 | P32246 | 4/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 1/20 | 0.44 |
| ▸ | CCR3 | P51677 | 1/20 | 0.44 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.41 |
| ▸ | PLD2 | O14939 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4800626 | 0.94 | SCN1A (0.75) | SCN1ASCN5ASCN9APLD1CCR1 | |
| SCHEMBL4803367 | 0.92 | SCN1A (0.66) | SCN1ASCN5ASCN9APLD1CCR1 | |
| SCHEMBL4800272 | 0.87 | SCN1A (0.69) | SCN1ASCN5ASCN9APLD1ABCB11 | |
| Hydrochloric Acid SCHEMBL4808473 | 0.86 | SCN1A (0.68) | SCN1ASCN5ASCN9APLD1ABCB11 | |
| SCHEMBL4806019 | 0.84 | OPRL1 (0.63) | PLD1KCNH2OPRL1PLD2 | |
| SCHEMBL4799829 | 0.81 | OPRL1 (0.57) | PLD1CCR1KCNH2HRH1CCR3 | |
| SCHEMBL4807512 | 0.80 | PLD2 (0.66) | PLD1KCNH2OPRL1PLD2 | |
| SCHEMBL4803925 | 0.78 | PLD2 (0.55) | PLD1KCNH2OPRL1PLD2 | |
| SCHEMBL4806618 | 0.78 | OPRL1 (0.62) | PLD1OPRL1PLD2 | |
| Hydrochloric Acid SCHEMBL4806574 | 0.77 | OPRL1 (0.61) | SCN1ASCN5ASCN9APLD1KCNH2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7388020-B2 | Benzimidazol derivatives modulate chemokine receptors | ASTRAZENECA AB (SE) | 2008-06-17 | — | — | US | claimed |
| US-20040116435-A1 | Benzimidazol derivatives modulate chemokine receptors | ASTRAZENECA AB (SE) | 2004-06-17 | — | — | US | claimed |
| US-7388020-B2 | Benzimidazol derivatives modulate chemokine receptors | ASTRAZENECA AB (SE) | 2008-06-17 | — | — | US | disclosed |
| US-20040116435-A1 | Benzimidazol derivatives modulate chemokine receptors | ASTRAZENECA AB (SE) | 2004-06-17 | — | — | US | disclosed |