Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19186073 | 0.95 | CYP1A1 (0.35) | CYP1A2CYP1A1CYP1B1MAPTL3MBTL1 | |
| SCHEMBL21541308 | 0.91 | CYP1A1 (0.32) | CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL21541219 | 0.90 | MAOA (0.37) | CYP1A2CYP1A1CYP1B1MAOAMAPT | |
| SCHEMBL21169380 | 0.90 | CYP1A1 (0.33) | CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL24115671 | 0.85 | — | — | |
| SCHEMBL23190911 | 0.84 | MAOA (0.45) | CYP1A2CYP1A1CYP1B1MAOAMAPT | |
| SCHEMBL27446517 | 0.83 | CYP1A1 (0.32) | CYP1A2CYP1A1CYP1B1 | |
| SCHEMBL22326830 | 0.83 | — | — | |
| SCHEMBL18893054 | 0.83 | — | — | |
| SCHEMBL24115627 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2786435-B1 | Compounds | NOVALED GMBH (DE) | 2019-07-17 | — | — | EP | disclosed |