Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | CRHBP | P24387 | 1/20 | 0.37 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.37 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | APP | P05067 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL16367810 | 0.98 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1CYP1A2CYP3A4MAPT | |
| SCHEMBL16367812 | 0.96 | ALDH1A1 (0.46) | ALDH1A1L3MBTL1CYP1A2CYP3A4MAPT | |
| SCHEMBL16367694 | 0.93 | L3MBTL1 (0.38) | ALDH1A1L3MBTL1CYP1A2CYP3A4MAPT | |
| SCHEMBL17368568 | 0.92 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1CYP1A2CYP3A4MAPT | |
| SCHEMBL17368569 | 0.92 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1CYP1A2CYP3A4MAPT | |
| SCHEMBL17816330 | 0.92 | BACE1 (0.37) | ALDH1A1L3MBTL1CYP1A2CYP3A4MAPT | |
| SCHEMBL17368566 | 0.92 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1CYP1A2CYP3A4MAPT | |
| SCHEMBL17368567 | 0.92 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1CYP1A2CYP3A4MAPT | |
| SCHEMBL17366496 | 0.90 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1CYP1A2CYP3A4MAPT | |
| SCHEMBL17366477 | 0.90 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1CYP1A2CYP3A4MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014204136-A1 | COMPOUND FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE INCLUDING THE SAME | SK CHEMICALS CO., LTD. (KR) | 2014-12-24 | — | — | WO | disclosed |