Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.45 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.41 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.41 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.41 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.41 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19003779 | 0.94 | ADORA2A (0.41) | ADORA2AADRA2CCLK4ALDH1A1CYP1A2 | |
| SCHEMBL13170640 | 0.91 | ADRA2C (0.46) | ADORA2AADRA2CCLK4ALDH1A1CYP1A2 | |
| SCHEMBL13170694 | 0.90 | ADRA2C (0.45) | ADORA2AADRA2CCLK4ALDH1A1CYP1A2 | |
| SCHEMBL13170672 | 0.89 | ADRA2C (0.44) | ADORA2AADRA2CCLK4ALDH1A1CYP1A2 | |
| SCHEMBL13170739 | 0.89 | ADRA2C (0.44) | ADORA2AADRA2CCLK4ALDH1A1CYP1A2 | |
| SCHEMBL13170664 | 0.89 | ADRA2C (0.44) | ADORA2AADRA2CCLK4ALDH1A1CYP1A2 | |
| SCHEMBL13170748 | 0.86 | PDK2 (0.43) | ADORA2AADRA2CCLK4ALDH1A1CYP1A2 | |
| SCHEMBL19003775 | 0.86 | CYP11B1 (0.45) | ADORA2AALDH1A1MEN1KMT2AADORA1 | |
| SCHEMBL13170642 | 0.85 | ADORA2A (0.46) | ADORA2AADRA2CCLK4ALDH1A1CYP1A2 | |
| SCHEMBL13170663 | 0.85 | PDK2 (0.43) | ADORA2AADRA2CCLK4ALDH1A1CYP1A2 |
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-2017104767-A1 | COMPOUND FOR ORGANIC ELECTROLUMINESCENT ELEMENT AND ORGANIC ELECTROLUMINESCENT ELEMENT USING SAME | TDK株式会社 | 2017-06-22 | — | — | WO | disclosed |