Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.35 |
| ▸ | MITF | O75030 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.34 |
| ▸ | PLAU | P00749 | 1/20 | 0.34 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.34 |
| ▸ | CBLB | Q13191 | 6/20 | 0.33 |
| ▸ | TRPM8 | Q7Z2W7 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 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 | |
|---|---|---|---|---|
| SCHEMBL20830065 | 0.74 | ALDH1A1 (0.44) | HSP90AA1NPC1RAB9A | |
| SCHEMBL12680178 | 0.72 | CYP1A2 (0.46) | CYP1A2CYP2A6PDPK1EGLN1MAP3K5 | |
| SCHEMBL26841009 | 0.70 | CYP1A2 (0.50) | CYP1A2CYP2A6PDPK1EGLN1MITF | |
| SCHEMBL26707149 | 0.69 | CYP1A2 (0.39) | CYP1A2CYP2A6PDPK1EGLN1MITF | |
| SCHEMBL18868517 | 0.68 | CYP1A2 (0.48) | CYP1A2CYP2A6PDPK1EGLN1MITF | |
| SCHEMBL22685157 | 0.68 | CYP1A2 (0.44) | CYP1A2CYP2A6PDPK1EGLN1MITF | |
| SCHEMBL17371067 | 0.68 | CYP1A2 (0.41) | CYP1A2CYP2A6PDPK1EGLN1MITF | |
| SCHEMBL12256868 | 0.68 | CYP1A2 (0.47) | CYP1A2CYP2A6PDPK1EGLN1MITF | |
| SCHEMBL30133777 | 0.66 | CYP1A2 (0.50) | CYP1A2CYP2A6PDPK1EGLN1MITF | |
| SCHEMBL2126619 | 0.66 | CYP1A2 (0.50) | CYP1A2CYP2A6PDPK1EGLN1MITF |
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 |
|---|---|---|---|---|---|---|---|
| US-9853218-B2 | High-molecular compound and light-emitting element using same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2017-12-26 | — | — | US | disclosed |