Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLYCD | O95822 | 1/20 | 0.51 |
| ▸ | PPARG | P37231 | 5/20 | 0.47 |
| ▸ | PPARA | Q07869 | 4/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.47 |
| ▸ | NAAA | Q02083 | 2/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | PPARD | Q03181 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1853396 | 0.90 | MLYCD (0.47) | MLYCDPPARGPPARAEPHX2NAAA | |
| SCHEMBL5047162 | 0.90 | HDAC1 (0.44) | MLYCDPPARGPPARAEPHX2NAAA | |
| SCHEMBL5039660 | 0.90 | HDAC1 (0.44) | MLYCDPPARGPPARAEPHX2NAAA | |
| SCHEMBL4978882 | 0.85 | PLK1 (0.47) | PPARASMN1; SMN2CYP1A2CYP2C9PLK1 | |
| SCHEMBL1855570 | 0.83 | MTTP (0.44) | PPARGPPARAEPHX2SMN1; SMN2MEN1 | |
| SCHEMBL4966603 | 0.81 | PLK1 (0.43) | PLK1 | |
| SCHEMBL1851806 | 0.80 | FFAR1 (0.50) | PPARGPPARAPPARDSMN1; SMN2CYP1A2 | |
| SCHEMBL5039508 | 0.80 | ROCK2 (0.44) | MLYCDPPARGPPARAEPHX2NAAA | |
| SCHEMBL28929298 | 0.80 | MLYCD (0.76) | MLYCDEPHX2NAAAL3MBTL1SMN1; SMN2 | |
| SCHEMBL1853969 | 0.80 | MLYCD (0.44) | MLYCDPPARGPPARAEPHX2NAAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1470102-B1 | SUBSTITUTED METHYLENE AMIDE DERIVATIVES AS MODULATORS OF PROTEIN TYROSINE PHOSPHATASES (PTPS) | MERCK SERONO SA (CH) | 2011-05-25 | — | — | EP | disclosed |