Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Methacrylic Acid SCHEMBL4656023 | 0.85 | ALDH1A1 (0.59) | ALDH1A1KEAP1SMN1; SMN2HDAC2HDAC8 | |
| Methacrylic Acid SCHEMBL31554944 | 0.83 | ALDH1A1 (0.57) | ALDH1A1KEAP1SMN1; SMN2HDAC2HDAC8 | |
| SCHEMBL476138 | 0.82 | TP53 (0.50) | ALDH1A1SMN1; SMN2HPGDMAOAMAOB | |
| Phenylethyl Alcohol SCHEMBL27472539 | 0.79 | TDP1 (0.64) | ALDH1A1KEAP1SMN1; SMN2HDAC2HDAC8 | |
| Ethylbenzene SCHEMBL27804631 | 0.79 | TP53 (0.61) | ALDH1A1SMN1; SMN2KDM4ELMNAKMT2A | |
| Butylbenzyl SCHEMBL28147500 | 0.76 | ALDH1A1 (0.55) | ALDH1A1SMN1; SMN2HDAC2HDAC8HDAC6 | |
| Methacrylic Acid SCHEMBL1082311 | 0.76 | ALDH1A1 (0.60) | ALDH1A1KEAP1SMN1; SMN2HDAC2HDAC8 | |
| Methacrylic Acid SCHEMBL31051021 | 0.75 | ALDH1A1 (0.48) | ALDH1A1KEAP1SMN1; SMN2HDAC2HDAC8 | |
| Butylbenzyl SCHEMBL28211360 | 0.75 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2HDAC2HDAC8HDAC6 | |
| Methacrylic Acid SCHEMBL11310406 | 0.75 | THRA (0.61) | ALDH1A1HPGDMAPTRXFP1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-103658097-A | Cleaning process | JOTUN AS | 2014-03-26 | — | — | CN | disclosed |