Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22868543 | 0.96 | PIM1 (0.34) | CYP1A2AURKAAURKBMAPTCYP3A4 | |
| SCHEMBL22868976 | 0.92 | MET (0.35) | CYP1A2ALDH1A1HSD17B10KDM4ETP53 | |
| SCHEMBL22868674 | 0.92 | MAPT (0.38) | CYP1A2ALDH1A1HSD17B10KDM4ETP53 | |
| SCHEMBL22868684 | 0.92 | ALDH1A1 (0.35) | CYP1A2ALDH1A1HSD17B10KDM4ETP53 | |
| SCHEMBL22868820 | 0.91 | MET (0.35) | CYP1A2ALDH1A1HSD17B10KDM4ETP53 | |
| SCHEMBL22868675 | 0.91 | ALDH1A1 (0.38) | CYP1A2ALDH1A1HSD17B10KDM4ETP53 | |
| SCHEMBL17151992 | 0.90 | PIM1 (0.37) | CYP1A2AURKAAURKBMAPTCYP3A4 | |
| SCHEMBL22868545 | 0.90 | L3MBTL1 (0.37) | CYP1A2ALDH1A1HSD17B10KDM4ETP53 | |
| SCHEMBL22868497 | 0.90 | L3MBTL1 (0.39) | CYP1A2ALDH1A1HSD17B10KDM4ETP53 | |
| SCHEMBL24275028 | 0.90 | CYP1A2 (0.34) | CYP1A2ALDH1A1HSD17B10KDM4ETP53 |
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 |
|---|---|---|---|---|---|---|---|
| US-20210005822-A1 | ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME | DUPONT SPECIALTY MATERIALS KOREA LTD (KR) | 2021-01-07 | — | — | US | disclosed |