Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 4/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALPG | P10696 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | 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 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 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 | |
|---|---|---|---|---|
| SCHEMBL10348527 | 1.00 | MAOB (0.40) | MAOBAPPAOC3CYP1A2CYP2C9 | |
| SCHEMBL11515864 | 0.79 | MAOB (0.41) | MAOBAPPAOC3CYP1A2CYP2C19 | |
| SCHEMBL11101055 | 0.79 | MAOB (0.40) | MAOBAPPAOC3CYP1A2CYP2C9 | |
| SCHEMBL11101052 | 0.79 | MAOB (0.40) | MAOBAPPAOC3CYP1A2CYP2C9 | |
| SCHEMBL10903565 | 0.79 | CA12 (0.46) | MAOBAPPAOC3CYP2C9 | |
| SCHEMBL10565634 | 0.79 | AOC3 (0.42) | MAOBAPPAOC3CYP1A2CYP2C9 | |
| SCHEMBL9658000 | 0.79 | AOC3 (0.42) | MAOBAPPAOC3CYP1A2CYP2C9 | |
| SCHEMBL2167367 | 0.78 | AOC3 (0.61) | MAOBAOC3CYP2C9CYP2C19KCNH2 | |
| SCHEMBL3453122 | 0.78 | CA12 (0.53) | MAOBAPPMAPTRAB9AHPGD | |
| SCHEMBL2167369 | 0.78 | AOC3 (0.61) | MAOBAOC3CYP2C9CYP2C19KCNH2 |
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-4590291-A | Thrombin inhibitory new dihydroxybenzene ether derivatives | BAYER AKTIENGESELLSCHAFT (DE) | 1986-05-20 | — | — | US | disclosed |
| EP-0068250-A1 | Dioxybenzene ether derivatives, pharmaceutical compositions containing them, process for the preparation thereof and their use | BAYER AG (DE) | 1983-01-05 | — | — | EP | disclosed |