Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | HPRT1 | P00492 | 2/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL17864059 | 0.95 | ALDH1A1 (0.41) | ALDH1A1CYP1B1HSD17B10HIF1AHPRT1 | |
| SCHEMBL17864111 | 0.88 | ALDH1A1 (0.39) | ALDH1A1CYP1B1HSD17B10HIF1AHPRT1 | |
| SCHEMBL13086925 | 0.86 | L3MBTL1 (0.40) | ALDH1A1CYP1B1HSD17B10HIF1ACYP1A1 | |
| SCHEMBL16362424 | 0.86 | MEN1 (0.40) | ALDH1A1MAPTL3MBTL1KDM4EMAPK1 | |
| SCHEMBL19986158 | 0.86 | MEN1 (0.42) | ALDH1A1MAPTL3MBTL1KDM4EMAPK1 | |
| SCHEMBL17864155 | 0.85 | HPRT1 (0.39) | ALDH1A1CYP1B1HPRT1CYP1A1MAPT | |
| SCHEMBL10027569 | 0.85 | MEN1 (0.43) | ALDH1A1MAPTL3MBTL1KDM4EMAPK1 | |
| SCHEMBL21388866 | 0.85 | MEN1 (0.46) | ALDH1A1MAPTL3MBTL1KDM4EMAPK1 | |
| SCHEMBL16066962 | 0.85 | L3MBTL1 (0.35) | ALDH1A1CYP1B1CYP1A1MAPTL3MBTL1 | |
| SCHEMBL17864118 | 0.84 | KDM4E (0.38) | ALDH1A1CYP1B1HSD17B10HIF1AHPRT1 |
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 |