Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.48 |
| ▸ | RELA | Q04206 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.44 |
| ▸ | PDE7A | Q13946 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | PDE7B | Q9NP56 | 2/20 | 0.43 |
| ▸ | CRHBP | P24387 | 1/20 | 0.43 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.43 |
| ▸ | EIF4E | P06730 | 3/20 | 0.43 |
| ▸ | KIF18A | Q8NI77 | 1/20 | 0.43 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL19997911 | 0.91 | ALDH1A1 (0.57) | ALDH1A1TDP1MAPTNPC1RAB9A | |
| SCHEMBL17870894 | 0.90 | RAB9A (0.55) | ALDH1A1TDP1MAPTNPC1RAB9A | |
| SCHEMBL25941799 | 0.90 | ALDH1A1 (0.58) | ALDH1A1TDP1MAPTNPC1RAB9A | |
| SCHEMBL25941819 | 0.88 | ALDH1A1 (0.53) | ALDH1A1TDP1MAPTNPC1RAB9A | |
| SCHEMBL26191612 | 0.88 | ALDH1A1 (0.61) | ALDH1A1TDP1MAPTNPC1RAB9A | |
| SCHEMBL19997893 | 0.88 | ALDH1A1 (0.61) | ALDH1A1TDP1MAPTNPC1RAB9A | |
| SCHEMBL9261807 | 0.86 | ALDH1A1 (0.61) | ALDH1A1TDP1MAPTNPC1RAB9A | |
| SCHEMBL2332563 | 0.86 | TDP1 (0.47) | ALDH1A1TDP1MAPTNPC1RAB9A | |
| SCHEMBL25941822 | 0.86 | ALDH1A1 (0.50) | ALDH1A1TDP1MAPTNPC1RAB9A | |
| SCHEMBL25941817 | 0.85 | MAPK1 (0.49) | ALDH1A1TDP1MAPTNPC1RAB9A |
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-2016105123-A2 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 주식회사 두산 | 2016-06-30 | — | — | WO | disclosed |
| WO-2016104954-A2 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 주식회사 두산 | 2016-06-30 | — | — | WO | disclosed |
| WO-2016105123-A2 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 주식회사 두산 | 2016-06-30 | — | — | WO | disclosed |
| WO-2016104954-A2 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 주식회사 두산 | 2016-06-30 | — | — | WO | disclosed |