Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.40 |
| ▸ | RELA | Q04206 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21019138 | 0.97 | NPC1 (0.44) | CLK4ALDH1A1RAB9ANPC1NFKB1 | |
| SCHEMBL21018825 | 0.93 | CLK4 (0.47) | CLK4ALDH1A1RAB9ANPC1NFKB1 | |
| SCHEMBL16614434 | 0.88 | SMN1; SMN2 (0.47) | CLK4ALDH1A1RAB9ANPC1NFKB1 | |
| SCHEMBL6449344 | 0.85 | ALDH1A1 (0.50) | ALDH1A1RAB9ANPC1NFKB1NFKB2 | |
| SCHEMBL12593268 | 0.85 | ALDH1A1 (0.50) | ALDH1A1RAB9ANPC1NFKB1NFKB2 | |
| SCHEMBL12781330 | 0.85 | ALDH1A1 (0.50) | ALDH1A1RAB9ANPC1NFKB1NFKB2 | |
| SCHEMBL21919140 | 0.85 | ALDH1A1 (0.50) | ALDH1A1RAB9ANPC1NFKB1NFKB2 | |
| SCHEMBL10075958 | 0.85 | ALDH1A1 (0.50) | ALDH1A1RAB9ANPC1NFKB1NFKB2 | |
| SCHEMBL12619867 | 0.85 | ALDH1A1 (0.50) | ALDH1A1RAB9ANPC1NFKB1NFKB2 | |
| SCHEMBL13930211 | 0.85 | ALDH1A1 (0.50) | ALDH1A1RAB9ANPC1NFKB1NFKB2 |
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-2017090918-A1 | COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE COMPRISING SAME | 덕산네오룩스 주식회사 | 2017-06-01 | — | — | WO | disclosed |