Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 9/20 | 0.57 |
| ▸ | MAOA | P21397 | 3/20 | 0.57 |
| ▸ | CXCL12 | P48061 | 2/20 | 0.55 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | ACHE | P22303 | 1/20 | 0.47 |
| ▸ | ABCG2 | Q9UNQ0 | 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 | |
|---|---|---|---|---|
| SCHEMBL3686697 | 1.00 | MAOB (0.57) | MAOBMAOACXCL12CYP1B1CYP1A2 | |
| SCHEMBL3688246 | 1.00 | MAOB (0.57) | MAOBMAOACXCL12CYP1B1CYP1A2 | |
| SCHEMBL30383554 | 1.00 | MAOB (0.57) | MAOBMAOACXCL12CYP1B1CYP1A2 | |
| Fumaric Acid SCHEMBL25209965 | 0.95 | MAOB (0.52) | MAOBMAOACXCL12CYP1B1CYP1A2 | |
| SCHEMBL3691653 | 0.88 | TLR9 (0.61) | MAOBCYP1B1MAPT | |
| SCHEMBL3697803 | 0.88 | TLR9 (0.61) | MAOBCYP1B1MAPT | |
| SCHEMBL3691651 | 0.88 | TLR9 (0.61) | MAOBCYP1B1MAPT | |
| SCHEMBL3682132 | 0.87 | MAPT (0.59) | MAOBCYP1B1MAPTHPGDBCHE | |
| SCHEMBL3682133 | 0.87 | BCHE (0.62) | MAOBMAOACYP1B1MAPTBCHE | |
| SCHEMBL30383292 | 0.87 | BCHE (0.62) | MAOBMAOACYP1B1MAPTBCHE |
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-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 |