Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 3/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.41 |
| ▸ | CRHBP | P24387 | 1/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | PABPC1 | P11940 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12179524 | 0.83 | HKDC1 (0.62) | HKDC1KEAP1NFE2L2CRHBPCRHR2 | |
| SCHEMBL10015446 | 0.82 | KEAP1 (0.64) | HKDC1KEAP1NFE2L2CRHBPCRHR2 | |
| SCHEMBL14701820 | 0.81 | HKDC1 (0.43) | HKDC1KEAP1NFE2L2CRHBPCRHR2 | |
| SCHEMBL24832200 | 0.81 | ALDH1A1 (0.65) | HKDC1KEAP1NFE2L2CRHBPCRHR2 | |
| SCHEMBL14700655 | 0.79 | HKDC1 (0.44) | HKDC1KEAP1NFE2L2CRHBPCRHR2 | |
| SCHEMBL12179718 | 0.78 | HKDC1 (0.48) | HKDC1KEAP1NFE2L2CRHBPCRHR2 | |
| SCHEMBL12179526 | 0.75 | HKDC1 (0.46) | HKDC1KEAP1NFE2L2CRHBPCRHR2 | |
| SCHEMBL23806086 | 0.75 | KDM4E (0.33) | ALDH1A1L3MBTL1TSHRMAPK1KDM4E | |
| SCHEMBL14262717 | 0.74 | ALDH1A1 (0.46) | CRHBPCRHR2ALDH1A1L3MBTL1HPGD | |
| SCHEMBL5899225 | 0.74 | ALDH1A1 (0.50) | CRHBPCRHR2ALDH1A1L3MBTL1MAPK1 |
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-2011136155-A1 | NOVEL ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | CANON KABUSHIKI KAISHA (JP) | 2011-11-03 | — | — | WO | disclosed |