Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | PIM1 | P11309 | 2/20 | 0.37 |
| ▸ | ESR1 | P03372 | 4/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | MYB | P10242 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.32 |
| ▸ | FEN1 | P39748 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.31 |
| ▸ | DHODH | Q02127 | 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 | |
|---|---|---|---|---|
| SCHEMBL13985609 | 0.89 | MCL1 (0.38) | MCL1PIM1ESR1ESR2CYP11B1 | |
| SCHEMBL8780567 | 0.81 | MCL1 (0.41) | MCL1PIM1ESR1ESR2CYP11B1 | |
| SCHEMBL13249122 | 0.74 | DHODH (0.34) | MCL1ESR1ESR2CYP11B1CYP11B2 | |
| SCHEMBL16122068 | 0.71 | MCL1 (0.50) | MCL1PIM1ESR1ESR2CYP11B1 | |
| SCHEMBL8780578 | 0.71 | ALDH1A1 (0.47) | MYBCES1ALDH1A1HIF1ACYP1B1 | |
| SCHEMBL17197648 | 0.70 | CA1 (0.40) | PIM1ESR1ESR2CA1CA2 | |
| SCHEMBL2709174 | 0.70 | CES1 (0.41) | CES1KDM4EALDH1A1HIF1ACYP1B1 | |
| SCHEMBL2551156 | 0.70 | ALDH1A1 (0.52) | CES1KDM4EALDH1A1HIF1ACYP1B1 | |
| SCHEMBL2867534 | 0.68 | ALDH1A1 (0.58) | CES1KDM4EALDH1A1HIF1ACYP1B1 | |
| SCHEMBL5750401 | 0.68 | CA1 (0.46) | PIM1KDM4ECA1CA2ALDH1A1 |
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 |