Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AMY1A | P0DUB6 | 2/20 | 0.58 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | HPSE | Q9Y251 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | PDE5A | O76074 | 2/20 | 0.46 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.46 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.46 |
| ▸ | GUSB | P08236 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7396331 | 0.86 | KDM4E (0.53) | AMY1ARAB9ANPC1KDM4EPDE5A | |
| SCHEMBL7395552 | 0.83 | PARP1 (0.59) | AMY1ARAB9ANPC1KMT2AHPSE | |
| SCHEMBL7992209 | 0.80 | AMY1A (0.43) | AMY1ARAB9ANPC1KMT2AKDM4E | |
| SCHEMBL7394125 | 0.77 | AMY1A (0.54) | AMY1ARAB9ANPC1KMT2AHPSE | |
| SCHEMBL2096956 | 0.77 | AMY1A (0.76) | AMY1ARAB9ANPC1PARP1KDM4E | |
| SCHEMBL31027930 | 0.77 | AMY1A (0.76) | AMY1ARAB9ANPC1PARP1KDM4E | |
| SCHEMBL31429666 | 0.76 | AMY1A (0.71) | AMY1ARAB9ANPC1KMT2AKDM4E | |
| SCHEMBL7393458 | 0.76 | AMY1A (0.71) | AMY1ARAB9ANPC1KMT2AKDM4E | |
| SCHEMBL7398763 | 0.76 | AMY1A (0.50) | AMY1ARAB9ANPC1KDM4EALDH1A1 | |
| SCHEMBL7389695 | 0.75 | PARP1 (0.51) | AMY1ARAB9ANPC1KMT2AHPSE |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2001066526-A1 | ESTER DERIVATIVES OF DIMETHYLPROPIONIC ACID AND PHARMACETUICAL COMPOSITIONS CONTAINING THEM | CERMOL S.A. (CH) | 2001-09-13 | — | — | WO | claimed |
| EP-1132381-A1 | Ester derivatives of dimethylpropionic acid and pharmaceutical compositions containing them | CERMOL S.A. (CH) | 2001-09-12 | — | — | EP | claimed |
| EP-1132381-A1 | Ester derivatives of dimethylpropionic acid and pharmaceutical compositions containing them | CERMOL S.A. (CH) | 2001-09-12 | — | — | EP | disclosed |