Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.75 |
| ▸ | TSHR | P16473 | 3/20 | 0.75 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.75 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.75 |
| ▸ | TP53 | P04637 | 1/20 | 0.75 |
| ▸ | ACHE | P22303 | 1/20 | 0.75 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Dimpylate SCHEMBL9812732 | 0.88 | ALDH1A1 (0.92) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL6118696 | 0.86 | ALDH1A1 (1.00) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL17453 | 0.86 | ALDH1A1 (1.00) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL3756703 | 0.85 | ALDH1A1 (0.87) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL27440593 | 0.85 | ALDH1A1 (0.87) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL28706929 | 0.85 | ALDH1A1 (0.92) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL4747660 | 0.85 | ALDH1A1 (0.92) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL6214077 | 0.84 | ALDH1A1 (0.97) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL1344740 | 0.84 | ALDH1A1 (0.97) | ALDH1A1TSHRCYP3A4HSD17B10TP53 | |
| Dimpylate SCHEMBL3841005 | 0.84 | ALDH1A1 (0.97) | ALDH1A1TSHRCYP3A4HSD17B10TP53 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101690496-A | O,O-methyl ethyl-O-(2-isopropyl-6-methyl-4-pyrimidyl) thiophosphate pesticide | DEQUN SUN | 2010-04-07 | — | — | CN | disclosed |
| CN-101690496-A | O,O-methyl ethyl-O-(2-isopropyl-6-methyl-4-pyrimidyl) thiophosphate pesticide | DEQUN SUN | 2010-04-07 | — | — | CN | disclosed |
| WO-1992004344-A1 | BICYCLO(3.1.0)HEXANE AMINES AND BICYCLO(4.1.0)-HEPTANE AMINES AS AGRICULTURAL FUNGICIDES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1992-03-19 | — | — | WO | disclosed |