Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 5/20 | 0.75 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.75 |
| ▸ | FAAH | O00519 | 1/20 | 0.75 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.75 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | CRHBP | P24387 | 1/20 | 0.53 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | BCHE | P06276 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Desmedipham SCHEMBL3230751 | 0.98 | MAPK1 (0.79) | MAPK1ALDH1A1FAAHCYP3A4MTNR1B | |
| SCHEMBL134424 | 0.91 | MAPK1 (0.77) | MAPK1ALDH1A1FAAHCYP3A4MTNR1B | |
| SCHEMBL29512574 | 0.91 | MAPK1 (0.77) | MAPK1ALDH1A1FAAHCYP3A4MTNR1B | |
| Phenmedipham SCHEMBL10647210 | 0.91 | CYP3A4 (0.92) | MAPK1ALDH1A1FAAHCYP3A4MAPT | |
| Desmedipham SCHEMBL55084 | 0.89 | MAPK1 (0.68) | MAPK1ALDH1A1FAAHCYP3A4MTNR1B | |
| Desmedipham SCHEMBL4895813 | 0.89 | MAPK1 (0.68) | MAPK1ALDH1A1FAAHCYP3A4MTNR1B | |
| Desmedipham SCHEMBL29516752 | 0.89 | MAPK1 (0.68) | MAPK1ALDH1A1FAAHCYP3A4MTNR1B | |
| Phenmedipham SCHEMBL8489570 | 0.87 | CYP3A4 (1.00) | MAPK1ALDH1A1FAAHCYP3A4MAPT | |
| SCHEMBL54581 | 0.87 | CYP3A4 (0.83) | MAPK1ALDH1A1FAAHCYP3A4MAPT | |
| Phenmedipham SCHEMBL54580 | 0.87 | CYP3A4 (1.00) | MAPK1ALDH1A1FAAHCYP3A4MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2001830-A1 | GLYCERIDE ESTER DERIVATIVES OF HERBICIDAL COMPOUNDS AND COMPOSITIONS THEREOF | NUFARM AUSTRALIA LIMITED (AU) | 2008-12-17 | — | — | EP | disclosed |
| WO-2007112505-A1 | GLYCERIDE ESTER DERIVATIVES OF HERBICIDAL COMPOUNDS AND COMPOSITIONS THEREOF | NUFARM AUSTRALIA LIMITED (AU) | 2007-10-11 | — | — | WO | disclosed |