Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | PRNP | P04156 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.32 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.31 |
| ▸ | FYN | P06241 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1373855 | 0.87 | CYP2D6 (0.43) | CYP2D6CYP2C19ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL12806720 | 0.77 | ALDH1A1 (0.36) | CYP2D6CYP2C19ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL13286516 | 0.75 | HSD17B10 (0.46) | ALDH1A1CYP1A2HPGDHSD17B10HIF1A | |
| SCHEMBL1373429 | 0.75 | HSD17B10 (0.50) | CYP2D6CYP2C19ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL1104888 | 0.74 | MAPK1 (0.43) | CYP2D6CYP2C19ALDH1A1HPGDMEN1 | |
| SCHEMBL10025826 | 0.71 | ALDH1A1 (0.50) | CYP2D6CYP2C19ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL30562854 | 0.71 | AHR (0.36) | CYP2D6CYP2C19ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL184768 | 0.69 | ALDH1A1 (0.59) | CYP2D6CYP2C19ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL4903130 | 0.69 | ALDH1A1 (0.40) | CYP2D6CYP2C19ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL10044508 | 0.69 | RXFP1 (0.39) | ALDH1A1CYP1A2MEN1PRNPMAPT |
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-2161319-A2 | Benzo(c)phenanthrene derivatives and organic electroluminescent device using the same | Gracel Display Inc. (KR) | 2010-03-10 | — | — | EP | disclosed |