Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 4/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.42 |
| ▸ | PDE4C | Q08493 | 4/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 4/20 | 0.42 |
| ▸ | MAOA | P21397 | 3/20 | 0.40 |
| ▸ | MAOB | P27338 | 3/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9719254 | 1.00 | PDE4A (0.42) | PDE4APDE4BPDE4CPDE4DMAOA | |
| SCHEMBL9719118 | 1.00 | PDE4A (0.42) | PDE4APDE4BPDE4CPDE4DMAOA | |
| SCHEMBL9719204 | 1.00 | PDE4A (0.42) | PDE4APDE4BPDE4CPDE4DMAOA | |
| Hydrochloric Acid SCHEMBL9719186 | 0.99 | PDE4A (0.41) | PDE4APDE4BPDE4CPDE4DMAOA | |
| SCHEMBL9719142 | 0.99 | MAOA (0.41) | PDE4APDE4BPDE4CPDE4DMAOA | |
| SCHEMBL9719140 | 0.96 | MAOA (0.41) | MAOAMAOBF2ELANEGSK3B | |
| SCHEMBL10946135 | 0.85 | MAOA (0.39) | MAOAMAOB | |
| SCHEMBL10946541 | 0.85 | MAOA (0.39) | MAOAMAOB | |
| SCHEMBL10943568 | 0.85 | MAOA (0.39) | MAOAMAOB | |
| SCHEMBL9719127 | 0.84 | MAOA (0.37) | MAOAMAOBGSK3B |
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 |
|---|---|---|---|---|---|---|---|
| US-5104885-A | 5-(phenylalkoxy)primaquine and 5[(heterocycle)alkoxy] primaquine compounds and their use for treatment of malaria | CALSPAN CORPORATION (US) | 1992-04-14 | — | — | US | disclosed |
| US-4980360-A | NONTOXIC AT HIGHER DOSAGES | CALSPAN CORPORATION (US) | 1990-12-25 | — | — | US | disclosed |