Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
| ▸ | TBXAS1 | P24557 | 6/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | PTGIS | Q16647 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL18979782 | 0.94 | RXFP1 (0.47) | HDAC1HDAC3HDAC4HDAC7HDAC2 | |
| SCHEMBL18979709 | 0.90 | KEAP1 (0.41) | MAPK1ALDH1A1MAPTFFAR1LMNA | |
| SCHEMBL18979865 | 0.81 | HDAC1 (0.42) | HDAC1HDAC3MAPK1ADRA1AHDAC4 | |
| SCHEMBL13772975 | 0.78 | SMN1; SMN2 (0.48) | HDAC1HDAC3MAPK1ADRA1AHDAC4 | |
| SCHEMBL18979838 | 0.77 | CA1 (0.42) | SLC6A3TBXAS1PTGS1PTGS2ALDH1A1 | |
| SCHEMBL13772976 | 0.72 | TBXAS1 (0.52) | HDAC1HDAC3HDAC4SMN1; SMN2HDAC7 | |
| SCHEMBL4799199 | 0.72 | PTGER1 (0.37) | HDAC1MAPK1TBXAS1PTGS1PTGS2 | |
| SCHEMBL28345767 | 0.71 | FABP4 (0.45) | HDAC1HDAC3MAPK1ADRA1AHDAC4 | |
| SCHEMBL5512368 | 0.70 | FABP4 (0.46) | HDAC1HDAC3MAPK1ADRA1AHDAC4 | |
| SCHEMBL1664496 | 0.70 | LMNA (0.44) | HDAC1HDAC4HDAC7HDAC8HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| US-20170176470-A1 | DETECTION OF CARBOXYALKYLPYRROLE OR PENTYLPYRROLE ETHANOLAMINE PHOSPHOLIPIDS | UNIV CASE WESTERN RESERVE (US) | 2017-06-22 | — | — | US | disclosed |