Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.55 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.55 |
| ▸ | AURKA | O14965 | 1/20 | 0.50 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.50 |
| ▸ | ACACA | Q13085 | 2/20 | 0.49 |
| ▸ | ELANE | P08246 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.48 |
| ▸ | MEN1 | O00255 | 6/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | RECQL | P46063 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 5/20 | 0.47 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL19618321 | 1.00 | CYP1A1 (0.55) | CYP1A1CYP1B1AURKAAURKBACACA | |
| SCHEMBL19618301 | 0.96 | CYP1A1 (0.49) | CYP1A1CYP1B1AURKAAURKBACACA | |
| SCHEMBL19618299 | 0.94 | CYP1A1 (0.52) | CYP1A1CYP1B1AURKAAURKBACACA | |
| SCHEMBL19618313 | 0.92 | CYP1A1 (0.52) | CYP1A1CYP1B1AURKAAURKBACACA | |
| SCHEMBL19618596 | 0.91 | CYP1A1 (0.49) | CYP1A1CYP1B1AURKAAURKBACACA | |
| SCHEMBL19618601 | 0.91 | CYP1A1 (0.49) | CYP1A1CYP1B1AURKAAURKBACACA | |
| SCHEMBL19618390 | 0.90 | ALDH1A1 (0.54) | AURKAAURKBACACAELANEALDH1A1 | |
| SCHEMBL19618331 | 0.90 | ALDH1A1 (0.54) | AURKAAURKBACACAELANEALDH1A1 | |
| SCHEMBL19618458 | 0.90 | ALDH1A1 (0.54) | AURKAAURKBACACAELANEALDH1A1 | |
| SCHEMBL19618326 | 0.90 | ALDH1A1 (0.54) | AURKAAURKBACACAELANEALDH1A1 |
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-9825242-B2 | Compound for organic optoelectric device, organic light-emitting diode including same, display device including organic light-emitting diode | CHEIL INDUSTRIES, INC. (KR) | 2017-11-21 | — | — | US | disclosed |
| US-9825242-B2 | Compound for organic optoelectric device, organic light-emitting diode including same, display device including organic light-emitting diode | CHEIL INDUSTRIES, INC. (KR) | 2017-11-21 | — | — | US | disclosed |