Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 1/20 | 0.39 |
| ▸ | JAK1 | P23458 | 1/20 | 0.39 |
| ▸ | TYK2 | P29597 | 1/20 | 0.39 |
| ▸ | JAK3 | P52333 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 9/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 5/20 | 0.36 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6064158 | 0.80 | CHRM1 (0.43) | JAK2JAK1TYK2JAK3GPR119 | |
| SCHEMBL6064154 | 0.80 | CHRM1 (0.43) | JAK2JAK1TYK2JAK3GPR119 | |
| SCHEMBL6064471 | 0.71 | PDE4B (0.53) | PDE4APDE4BPDE4DHTR3A | |
| SCHEMBL6064470 | 0.71 | PDE4B (0.53) | PDE4APDE4BPDE4DHTR3A | |
| SCHEMBL6063161 | 0.70 | PDE4A (0.52) | PDE4APDE4BPDE4DUSP30 | |
| SCHEMBL3537378 | 0.70 | GAA (0.55) | GPR119CHRM2CHRM1CHRM3 | |
| SCHEMBL3537373 | 0.70 | GAA (0.55) | GPR119CHRM2CHRM1CHRM3 | |
| SCHEMBL6063525 | 0.69 | PDE4B (0.58) | PDE4APDE4BPDE4D | |
| SCHEMBL16509796 | 0.68 | HPGDS (0.58) | GPR119USP30 | |
| SCHEMBL13572980 | 0.68 | HPGDS (0.58) | GPR119USP30 |
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-2003068233-A1 | NICOTINAMIDE DERIVATIVES AND A TIOTROPIUM SALT IN COMBINATION FOR THE TREATMENT OF E.G. INFLAMMATORY, ALLERGIC AND RESPIRATORY DISEASES | PFIZER LIMITED (GB) | 2003-08-21 | — | — | WO | disclosed |