Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.38 |
| ▸ | NUDT1 | P36639 | 3/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21213859 | 0.98 | ALDH1A1 (0.48) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL17864124 | 0.95 | ALDH1A1 (0.46) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL17864126 | 0.93 | ALDH1A1 (0.44) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL17864058 | 0.91 | ALDH1A1 (0.38) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL17864104 | 0.90 | ALDH1A1 (0.40) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL21213399 | 0.88 | ALDH1A1 (0.40) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL17206503 | 0.87 | ALDH1A1 (0.52) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL12014834 | 0.87 | ALDH1A1 (0.52) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL17864128 | 0.87 | ALDH1A1 (0.38) | ALDH1A1HPGDKDM4EMAPTNPSR1 | |
| SCHEMBL21213403 | 0.87 | ALDH1A1 (0.41) | ALDH1A1HPGDKDM4EMAPTNPSR1 |
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 |