Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HTR1B | P28222 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4592908 | 0.78 | CYP2A6 (0.43) | ALDH1A1CYP2A6CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL29416020 | 0.78 | CYP2A6 (0.43) | ALDH1A1CYP2A6CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL29416023 | 0.74 | CYP2A6 (0.40) | ALDH1A1CYP2A6CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL19809434 | 0.74 | CYP2A6 (0.40) | ALDH1A1CYP2A6CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL781379 | 0.74 | ALDH1A1 (0.43) | ALDH1A1CYP2A6CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL11115232 | 0.71 | ALDH1A1 (0.37) | ALDH1A1CYP2A6CYP1A2CYP2C19TDP1 | |
| SCHEMBL4582431 | 0.70 | ALDH1A1 (0.48) | ALDH1A1CYP2A6CYP1A2CYP2C19CYP2D6 | |
| SCHEMBL30184794 | 0.69 | ALDH1A1 (0.50) | ALDH1A1CYP2A6CYP1A2CYP2C19TDP1 | |
| SCHEMBL6831899 | 0.69 | ALDH1A1 (0.50) | ALDH1A1CYP2A6CYP1A2CYP2C19TDP1 | |
| SCHEMBL16487309 | 0.69 | KDM4E (0.39) | ALDH1A1CYP2A6CYP1A2CYP2C19TDP1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7604874-B2 | Organic compounds for electroluminescence and organic electroluminescent devices using the same | LG CHEM, LTD. (KR) | 2009-10-20 | — | — | US | disclosed |
| US-7485733-B2 | Organic compounds for electroluminescence and organic electroluminescent devices using the same | LG CHEM, LTD. (KR) | 2009-02-03 | — | — | US | disclosed |
| US-20070037012-A1 | having an anthracene compound substituted with at least one thiophenyl ring; OLED organic light emitters; as displays with low power consumption, faster response time, higher brightness level, unlimited viewing angle | LG CHEM, LTD. (KR) | 2007-02-15 | — | — | US | disclosed |
| EP-1501821-A1 | NEW ORGANIC COMPOUNDS FOR ELECTROLUMINESCENCE AND ORGANIC ELECTROLUMINESCENT DEVICES USING THE SAME | LG Chem, Ltd. (KR) | 2005-02-02 | — | — | EP | disclosed |
| US-20040067387-A1 | Organic compounds for electroluminescence and organic electroluminescent devices using the same | LG CHEM. LTD. (KR) | 2004-04-08 | — | — | US | disclosed |
| WO-2003095445-A1 | NEW ORGANIC COMPOUNDS FOR ELECTROLUMINESCENCE AND ORGANIC ELECTROLUMINESCENT DEVICES USING THE SAME | LG CHEM, LTD. (KR) | 2003-11-20 | — | — | WO | disclosed |