Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.59 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.59 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.59 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.59 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.55 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.52 |
| ▸ | JUN | P05412 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | ATM | Q13315 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.48 |
| ▸ | APP | P05067 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL3690295 | 0.92 | MAPT (0.60) | PDE4APDE4BPDE4CPDE4DABCG2 | |
| SCHEMBL3685698 | 0.88 | AR (0.60) | PTPN1MAPTLMNAKDM4EMAOB | |
| SCHEMBL3686633 | 0.88 | AR (0.60) | PTPN1MAPTLMNAKDM4EMAOB | |
| SCHEMBL3695218 | 0.87 | MAPT (0.59) | PDE4APDE4BPDE4CPDE4DABCG2 | |
| SCHEMBL6050485 | 0.87 | MAPT (0.59) | PDE4APDE4BPDE4CPDE4DABCG2 | |
| SCHEMBL3686915 | 0.86 | MAOB (0.46) | PDE4APDE4BPDE4CPDE4DABCG2 | |
| SCHEMBL3682205 | 0.86 | MAOB (0.46) | PDE4APDE4BPDE4CPDE4DABCG2 | |
| SCHEMBL3690293 | 0.85 | ABCG2 (0.62) | PDE4APDE4BPDE4CPDE4DABCG2 | |
| SCHEMBL3694613 | 0.85 | ABCG2 (0.62) | PDE4APDE4BPDE4CPDE4DABCG2 | |
| SCHEMBL3691412 | 0.84 | ABCG2 (0.54) | ABCG2PTPN1LMNASMN1; SMN2MAOB |
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-20060235073-A1 | Diamino-functional chalcones | LICA PHARMACEUTICALS A/S (DK) | 2006-10-19 | — | — | US | claimed |
| US-7642367-B2 | Diamino-functional chalcones | LICA PHARMACEUTICALS A/S (DK) | 2010-01-05 | — | — | US | disclosed |
| US-20060235073-A1 | Diamino-functional chalcones | LICA PHARMACEUTICALS A/S (DK) | 2006-10-19 | — | — | US | disclosed |