Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | CASP7 | P55210 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
| ▸ | HPRT1 | P00492 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 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 | |
|---|---|---|---|---|
| SCHEMBL13985496 | 0.83 | ALDH1A1 (0.42) | ALDH1A1HSD17B10HIF1ACYP1B1HPGD | |
| SCHEMBL13985499 | 0.81 | ALDH1A1 (0.40) | ALDH1A1HSD17B10HIF1ACYP1B1CYP1A2 | |
| SCHEMBL9612574 | 0.80 | HSD17B10 (0.40) | ALDH1A1HSD17B10HIF1ACYP1B1HPGD | |
| SCHEMBL20407098 | 0.76 | CYP1A2 (0.48) | ALDH1A1HSD17B10HIF1ACYP1B1HPGD | |
| SCHEMBL27885451 | 0.75 | ALDH1A1 (0.62) | ALDH1A1HSD17B10HIF1ACYP1B1HPGD | |
| SCHEMBL598738 | 0.74 | ALDH1A1 (0.60) | ALDH1A1HSD17B10HIF1ACYP1B1HPGD | |
| SCHEMBL9612453 | 0.74 | ALDH1A1 (0.34) | ALDH1A1HSD17B10HIF1ACYP1B1HPGD | |
| SCHEMBL13249098 | 0.73 | ALDH1A1 (0.46) | ALDH1A1HSD17B10HIF1ACYP1B1HPGD | |
| SCHEMBL1760677 | 0.72 | ALDH1A1 (0.62) | ALDH1A1HSD17B10HIF1ACYP1B1HPGD | |
| SCHEMBL9612371 | 0.71 | ALDH1A1 (0.39) | ALDH1A1HSD17B10HIF1ACYP1B1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-2148909-B1 | BENZANTHRACENE DERIVATIVES FOR ORGANIC ELECTROLUMINESCENT DEVICES | MERCK PATENT GMBH (DE) | 2012-05-30 | — | — | EP | disclosed |