Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGAM | O43451 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | SI | P14410 | 1/20 | 0.52 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.52 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.52 |
| ▸ | RAF1 | P04049 | 1/20 | 0.52 |
| ▸ | BRAF | P15056 | 1/20 | 0.52 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.52 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.52 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.52 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.50 |
| ▸ | LDHA | P00338 | 1/20 | 0.50 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.49 |
| ▸ | ATR | Q13535 | 1/20 | 0.48 |
| ▸ | PARP1 | P09874 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL10962938 | 0.84 | CYP11B1 (0.50) | BRAFKDM4ELDHAEPHX2ALDH1A1 | |
| SCHEMBL7279556 | 0.82 | NPC1 (0.52) | MAPK14KDM4ELDHAEPHX2ALDH1A1 | |
| SCHEMBL7270897 | 0.82 | CYP11B1 (0.58) | MGAMGAASIMGAM2MAPK13 | |
| SCHEMBL7271736 | 0.82 | KDM4E (0.52) | MGAMGAASIMGAM2MAPK13 | |
| SCHEMBL10742498 | 0.82 | GAA (0.55) | MGAMGAASIMGAM2MAPK13 | |
| SCHEMBL7271262 | 0.81 | ALDH1A1 (0.54) | MGAMGAASIMGAM2MAPK13 | |
| SCHEMBL7395100 | 0.81 | KDM4E (0.67) | MGAMGAASIMGAM2KDM4E | |
| Hydrochloric Acid SCHEMBL7270482 | 0.81 | CYP11B1 (0.57) | MGAMGAASIMGAM2MAPK13 | |
| SCHEMBL7127398 | 0.81 | NPC1 (0.65) | GAAMAPK13RAF1MAPK12MAPK11 | |
| SCHEMBL11231437 | 0.80 | KDM4E (0.76) | KDM4ELDHAEPHX2ATRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001066526-A1 | ESTER DERIVATIVES OF DIMETHYLPROPIONIC ACID AND PHARMACETUICAL COMPOSITIONS CONTAINING THEM | CERMOL S.A. (CH) | 2001-09-13 | — | — | WO | disclosed |
| EP-1132381-A1 | Ester derivatives of dimethylpropionic acid and pharmaceutical compositions containing them | CERMOL S.A. (CH) | 2001-09-12 | — | — | EP | disclosed |