Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | GRM5 | P41594 | 2/20 | 0.37 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.37 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.36 |
| ▸ | CCNC | P24863 | 1/20 | 0.36 |
| ▸ | CDK8 | P49336 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18174719 | 0.90 | DHODH (0.46) | CYP2A6HRH3CYP17A1CYP1A2TGFBR1 | |
| SCHEMBL18174633 | 0.89 | CYP2A6 (0.38) | CYP2A6GRM4CYP17A1DHODHS1PR1 | |
| SCHEMBL18174750 | 0.88 | GRM4 (0.43) | GRM4CYP17A1CYP1A2CYP19A1DHODH | |
| SCHEMBL18174752 | 0.88 | CYP3A4 (0.47) | CYP2A6GRM4CYP17A1CYP1A2CYP19A1 | |
| SCHEMBL18174732 | 0.88 | CYP2A6 (0.49) | CYP2A6GRM4CYP17A1CYP1A2TGFBR1 | |
| SCHEMBL18174663 | 0.88 | GRM4 (0.37) | CYP2A6GRM4CYP17A1TGFBR1CYP19A1 | |
| SCHEMBL18174736 | 0.87 | CYP2A6 (0.48) | CYP2A6GRM4CYP17A1CYP1A2TGFBR1 | |
| SCHEMBL18174753 | 0.85 | PIK3CA (0.45) | GRM4CYP17A1CYP1A2CYP19A1DHODH | |
| SCHEMBL18174725 | 0.84 | CYP2A6 (0.49) | CYP2A6GRM4CYP17A1CYP1A2CYP19A1 | |
| SCHEMBL18174755 | 0.84 | DHODH (0.41) | GRM4CYP17A1CYP1A2CYP19A1DHODH |
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 |