Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | NUDT1 | P36639 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.31 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL19918683 | 0.99 | ALDH1A1 (0.37) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL19918679 | 0.95 | ALDH1A1 (0.33) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL19918678 | 0.94 | ALDH1A1 (0.32) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL19918682 | 0.90 | PTGES (0.35) | ALDH1A1HPGDKDM4EMAPTPIK3CD | |
| SCHEMBL19918680 | 0.88 | MAPK1 (0.30) | MAPK1KMT2A | |
| SCHEMBL19918573 | 0.88 | PLA2G2A (0.32) | ALDH1A1HPGDKDM4EMAPTL3MBTL1 | |
| SCHEMBL16475761 | 0.88 | L3MBTL1 (0.35) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL19918681 | 0.88 | PIM1 (0.30) | — | |
| SCHEMBL19918485 | 0.88 | KDM4E (0.32) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL19918534 | 0.87 | TSPO (0.33) | ALDH1A1HPGDL3MBTL1MAPK1GAA |
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-2018038400-A1 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENCE DEVICE INCLUDING SAME | 주식회사 두산 | 2018-03-01 | — | — | WO | disclosed |