Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 4/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | SCN4A | P35499 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL9658000 | 1.00 | AOC3 (0.42) | AOC3MAOBAPPCYP1A2CYP2C9 | |
| SCHEMBL11229991 | 0.82 | MAOB (0.57) | AOC3MAOBAPPSCN4A | |
| SCHEMBL7403066 | 0.81 | AOC3 (0.64) | AOC3MAOBCYP2C9CYP2C19KCNH2 | |
| SCHEMBL7403068 | 0.81 | AOC3 (0.64) | AOC3MAOBCYP2C9CYP2C19KCNH2 | |
| SCHEMBL11101055 | 0.79 | MAOB (0.40) | AOC3MAOBAPPCYP1A2CYP2C9 | |
| SCHEMBL10348527 | 0.79 | MAOB (0.40) | AOC3MAOBAPPCYP1A2CYP2C9 | |
| SCHEMBL10905751 | 0.79 | MAOB (0.40) | AOC3MAOBAPPCYP1A2CYP2C9 | |
| SCHEMBL11101052 | 0.79 | MAOB (0.40) | AOC3MAOBAPPCYP1A2CYP2C9 | |
| SCHEMBL1714415 | 0.79 | MAOB (0.44) | AOC3MAOB | |
| SCHEMBL1714419 | 0.79 | MAOB (0.44) | AOC3MAOB |
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 |
|---|---|---|---|---|---|---|---|
| US-4797409-A | FUNGICIDES, YEAST INFECTIONS | HOECHST AKTIENGESELLSCHAFT (DE) | 1989-01-10 | — | — | US | disclosed |