Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2C | P18825 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | EGFR | P00533 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 5/20 | 0.46 |
| ▸ | DRD2 | P14416 | 5/20 | 0.46 |
| ▸ | HTR1A | P08908 | 2/20 | 0.42 |
| ▸ | HTR2C | P28335 | 2/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | NCF1 | P14598 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27536638 | 0.83 | L3MBTL1 (0.47) | KMT2ALMNAMAPTALDH1A1MEN1 | |
| SCHEMBL13006367 | 0.81 | ADRA2C (0.56) | ADRA2CKMT2AEGFRLMNAMAPT | |
| SCHEMBL27741259 | 0.79 | POLB (0.54) | LMNAMAPTHTR6ALDH1A1 | |
| SCHEMBL27762008 | 0.77 | ADRA2C (0.49) | ADRA2CKMT2AEGFRLMNAMAPT | |
| SCHEMBL27760543 | 0.76 | ADRA2C (0.55) | ADRA2CKMT2AEGFRLMNAMAPT | |
| SCHEMBL2113196 | 0.75 | ADRA2C (0.50) | ADRA2CKMT2AEGFRLMNAMAPT | |
| SCHEMBL27741262 | 0.74 | CHRNA7 (0.47) | DRD3DRD4HTR6ALDH1A1HDAC3 | |
| SCHEMBL24227168 | 0.73 | ADRA2C (0.47) | ADRA2CKMT2AEGFRLMNAMAPT | |
| SCHEMBL20376817 | 0.73 | ADRA2C (0.51) | ADRA2CKMT2AEGFRLMNAMAPT | |
| SCHEMBL16019523 | 0.73 | FAAH (0.52) | ADRA2CMAPTDRD2HTR1AALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101448802-B | Acrylamide derivative as histone deacetylase inhibitors for cancer treatment | DAC SRL | 2012-11-07 | — | — | CN | disclosed |
| CN-101448802-A | N-hydroxy-3-(4-{3-phenyl-S-oxo-propenyl}-phenyl)-acrylamide derivatives and related compounds as histone deacetylase inhibitors for the treatment of cancer | DAC SRL (IT) | 2009-06-03 | — | — | CN | disclosed |