Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 3/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13024065 | 0.93 | CYP2A6 (0.48) | ALDH1A1MAPK1ESR1ESR2CYP2A6 | |
| SCHEMBL19784928 | 0.93 | CYP2A6 (0.48) | ALDH1A1MAPK1ESR1ESR2CYP2A6 | |
| SCHEMBL29992507 | 0.93 | CYP2A6 (0.48) | ALDH1A1MAPK1ESR1ESR2CYP2A6 | |
| SCHEMBL14849850 | 0.93 | CYP2A6 (0.48) | ALDH1A1MAPK1ESR1ESR2CYP2A6 | |
| SCHEMBL12476179 | 0.93 | CYP2A6 (0.48) | ALDH1A1MAPK1ESR1ESR2CYP2A6 | |
| SCHEMBL556519 | 0.92 | CYP2A6 (0.53) | ALDH1A1MAPK1ESR1ESR2CYP2A6 | |
| SCHEMBL17740708 | 0.92 | ALDH1A1 (0.42) | ALDH1A1MAPK1ESR1ESR2CYP11B1 | |
| SCHEMBL4980612 | 0.91 | CYP2A6 (0.50) | ALDH1A1MAPK1ESR1ESR2CYP2A6 | |
| SCHEMBL2450924 | 0.91 | ESR1 (0.48) | ALDH1A1ESR1ESR2CYP11B1CYP11B2 | |
| SCHEMBL2448937 | 0.91 | ESR1 (0.48) | ALDH1A1ESR1ESR2CYP11B1CYP11B2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018021737-A1 | COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF | 덕산네오룩스 주식회사 | 2018-02-01 | — | — | WO | disclosed |
| WO-2018012780-A1 | COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME ORGANIC ELECTRIC ELEMENT | 덕산네오룩스 주식회사 | 2018-01-18 | — | — | WO | disclosed |
| WO-2017204556-A1 | COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME AND ELECTRONIC DEVICE THEREFOR | 덕산네오룩스 주식회사 | 2017-11-30 | — | — | WO | disclosed |
| WO-2016072691-A1 | ORGANIC ELECTRONIC DEVICE AND DISPLAY DEVICE USING COMPOSITION FOR ORGANIC ELECTRONIC DEVICE | 덕산네오룩스 주식회사 | 2016-05-12 | — | — | WO | disclosed |