Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.38 |
| ▸ | RXRA | P19793 | 1/20 | 0.36 |
| ▸ | RXRB | P28702 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | HPGD | P15428 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | NEK2 | P51955 | 1/20 | 0.32 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12394113 | 0.94 | CYP1A2 (0.54) | CYP1A2CYP2A6RXRARXRBMAPT | |
| SCHEMBL13908268 | 0.91 | CYP1A2 (0.43) | CYP1A2CYP2A6RXRARXRBMAPT | |
| SCHEMBL10053533 | 0.90 | CYP1A2 (0.54) | CYP1A2CYP2A6MAPTKDM4ESMN1; SMN2 | |
| SCHEMBL12031841 | 0.88 | ALDH1A1 (0.39) | CYP1A2RXRARXRBMAPTKDM4E | |
| SCHEMBL10128609 | 0.88 | ALDH1A1 (0.39) | CYP1A2RXRARXRBMAPTKDM4E | |
| SCHEMBL7214261 | 0.88 | ALDH1A1 (0.39) | CYP1A2RXRARXRBMAPTKDM4E | |
| SCHEMBL1455714 | 0.87 | CYP1A2 (0.46) | CYP1A2CYP2A6RXRARXRBMAPT | |
| SCHEMBL13868380 | 0.87 | CYP1A2 (0.46) | CYP1A2CYP2A6MAPTKDM4EALDH1A1 | |
| SCHEMBL12262924 | 0.86 | CYP1A2 (0.45) | CYP1A2CYP2A6MAPTKDM4ESMN1; SMN2 | |
| SCHEMBL14018317 | 0.86 | CYP1A2 (0.45) | CYP1A2CYP2A6RXRARXRBMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017204556-A1 | COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME AND ELECTRONIC DEVICE THEREFOR | 덕산네오룩스 주식회사 | 2017-11-30 | — | — | WO | disclosed |