Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACKR3 | P25106 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
| ▸ | USP2 | O75604 | 3/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 2/20 | 0.31 |
| ▸ | CASP7 | P55210 | 2/20 | 0.31 |
| ▸ | CA12 | O43570 | 2/20 | 0.31 |
| ▸ | CA1 | P00915 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | CA9 | Q16790 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | PDE4B | Q07343 | 5/20 | 0.31 |
| ▸ | PDE4D | Q08499 | 5/20 | 0.31 |
| ▸ | PDE4A | P27815 | 4/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7656864 | 0.98 | ACKR3 (0.34) | ACKR3CHRM1USP2CYP1A2CYP3A4 | |
| SCHEMBL7664799 | 0.91 | PDE4A (0.37) | CHRM1CA12CA1CA2CA9 | |
| SCHEMBL7663917 | 0.90 | PDE4A (0.38) | CHRM1CA12CA1CA2CA9 | |
| SCHEMBL7662878 | 0.90 | ACKR3 (0.36) | ACKR3CHRM1USP2CYP1A2CYP3A4 | |
| SCHEMBL7660922 | 0.89 | PDE4A (0.37) | USP2CYP1A2CYP3A4CYP2C9CASP1 | |
| SCHEMBL7652540 | 0.88 | PDE4A (0.37) | USP2CYP1A2CYP3A4CYP2C9CASP1 | |
| SCHEMBL7665495 | 0.85 | CAMK2D (0.41) | — | |
| SCHEMBL8516671 | 0.85 | CAMK2D (0.35) | ACKR3CHRM1USP2CYP1A2CYP3A4 | |
| SCHEMBL7663936 | 0.85 | CAMK2D (0.39) | USP2CYP1A2CYP3A4CYP2C9ALDH1A1 | |
| SCHEMBL7664149 | 0.84 | CAMK2D (0.41) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6458792-B1 | MEDICAMENT FOR THE TREATMENT OF INFLAMMATORY, IMMUNOLOGICAL, BRONCHOPULMONARY, CARDIOVASCULAR, ONCOLOGICAL OR CNS-DEGENERATIVE DISORDERS. | ASTRAZENECA AB (SE) | 2002-10-01 | — | — | US | disclosed |
| EP-1071683-A1 | NEW COMPOUNDS | AstraZeneca AB (SE) | 2001-01-31 | — | — | EP | disclosed |
| WO-1999046264-A1 | NEW COMPOUNDS | ASTRAZENECA AB (SE) | 1999-09-16 | — | — | WO | disclosed |