Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | CCR1 | P32246 | 1/20 | 0.42 |
| ▸ | CCR5 | P51681 | 1/20 | 0.42 |
| ▸ | CCR8 | P51685 | 1/20 | 0.42 |
| ▸ | TGFBR1 | P36897 | 4/20 | 0.42 |
| ▸ | MAP4K4 | O95819 | 4/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KMO | O15229 | 2/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.37 |
| ▸ | GRM5 | P41594 | 1/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18174592 | 0.95 | CYP2A6 (0.46) | CYP2A6CCR1CCR5CCR8TGFBR1 | |
| SCHEMBL18174674 | 0.92 | CYP2A6 (0.46) | CYP2A6CCR1CCR5CCR8TGFBR1 | |
| SCHEMBL15977629 | 0.92 | CYP2A6 (0.48) | CYP2A6CCR1CCR5CCR8TGFBR1 | |
| SCHEMBL15160984 | 0.92 | CYP2A6 (0.48) | CYP2A6CCR1CCR5CCR8TGFBR1 | |
| SCHEMBL10300894 | 0.92 | CYP2A6 (0.50) | CYP2A6CCR1CCR5CCR8TGFBR1 | |
| SCHEMBL18174577 | 0.90 | CYP2A6 (0.54) | CYP2A6CCR1CCR5CCR8TGFBR1 | |
| SCHEMBL10032893 | 0.87 | CYP2A6 (0.43) | CYP2A6CCR1CCR5CCR8TGFBR1 | |
| SCHEMBL18174741 | 0.87 | CYP2A6 (0.43) | CYP2A6CCR1CCR5CCR8TGFBR1 | |
| SCHEMBL2479816 | 0.85 | CYP2A6 (0.59) | CYP2A6CCR1CCR5CCR8TGFBR1 | |
| SCHEMBL10032753 | 0.85 | CYP2A6 (0.44) | CYP2A6CCR1CCR5CCR8CNR1 |
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-9478750-B2 | Anthracene derivative and organic electroluminescent element using the same | JNC CORPORATION (JP) | 2016-10-25 | — | — | US | disclosed |
| US-9478750-B2 | Anthracene derivative and organic electroluminescent element using the same | JNC CORPORATION (JP) | 2016-10-25 | — | — | US | disclosed |