Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | NUDT1 | P36639 | 3/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 3/20 | 0.31 |
| ▸ | RAD52 | P43351 | 1/20 | 0.31 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | FYN | P06241 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 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 | |
|---|---|---|---|---|
| SCHEMBL17864157 | 0.93 | ALDH1A1 (0.44) | ALDH1A1MAPTHPGDKDM4ENPSR1 | |
| SCHEMBL17864160 | 0.93 | ALDH1A1 (0.43) | ALDH1A1MAPTHPGDKDM4ENPSR1 | |
| SCHEMBL17864145 | 0.93 | ALDH1A1 (0.46) | ALDH1A1MAPTHPGDKDM4ENPSR1 | |
| SCHEMBL17864108 | 0.87 | ALDH1A1 (0.41) | ALDH1A1MAPTHPGDKDM4ENPSR1 | |
| SCHEMBL17864154 | 0.86 | ALDH1A1 (0.48) | ALDH1A1MAPTHPGDKDM4ENPSR1 | |
| SCHEMBL17864177 | 0.86 | ALDH1A1 (0.50) | ALDH1A1MAPTHPGDKDM4ENPSR1 | |
| SCHEMBL21888002 | 0.85 | ALDH1A1 (0.45) | ALDH1A1MAPTHPGDKDM4ENPSR1 | |
| SCHEMBL17864172 | 0.85 | ALDH1A1 (0.38) | ALDH1A1MAPTHPGDKDM4ENPSR1 | |
| SCHEMBL17206528 | 0.85 | ALDH1A1 (0.51) | ALDH1A1MAPTHPGDKDM4ENPSR1 | |
| SCHEMBL17864189 | 0.84 | ALDH1A1 (0.33) | ALDH1A1MAPTHPGDKDM4ENPSR1 |
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-2016099037-A2 | ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME | 주식회사 두산 | 2016-06-23 | — | — | WO | disclosed |