Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.58 |
| ▸ | RAB9A | P51151 | 4/20 | 0.58 |
| ▸ | MEN1 | O00255 | 4/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.58 |
| ▸ | KDR | P35968 | 1/20 | 0.56 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | EGFR | P00533 | 1/20 | 0.52 |
| ▸ | ABL1 | P00519 | 1/20 | 0.49 |
| ▸ | BCR | P11274 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1896051 | 0.90 | MEN1 (0.55) | NPC1RAB9AMEN1KMT2AKDR | |
| SCHEMBL14769593 | 0.87 | SCN9A (0.56) | NPC1RAB9AMEN1KMT2AKDR | |
| SCHEMBL12262588 | 0.85 | EGFR (0.51) | NPC1RAB9AMEN1KMT2AKDR | |
| SCHEMBL1897213 | 0.85 | KDR (0.80) | KDRTNNI3K | |
| SCHEMBL1894480 | 0.84 | MEN1 (0.52) | NPC1RAB9AMEN1KMT2AKDR | |
| SCHEMBL12262590 | 0.80 | EGFR (0.46) | NPC1RAB9AMEN1KMT2AKDR | |
| SCHEMBL1894470 | 0.80 | KDR (0.71) | KDRTNNI3K | |
| SCHEMBL414719 | 0.80 | MEN1 (0.70) | NPC1RAB9AMEN1KMT2ATNNI3K | |
| SCHEMBL8217612 | 0.80 | SMN1; SMN2 (0.71) | NPC1RAB9AMEN1KMT2AKDR | |
| SCHEMBL4345309 | 0.79 | EGFR (0.47) | NPC1RAB9AMEN1KMT2AKDR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000049001-A2 | PHENOXY-, PHENYLTHIO-, PHENYLAMINO-, BENZYLOXY-, BENZYLTHIO- OR BENZYLAMINOPYRIMIDINE INSECTIDICES AND ACARICIDES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 2000-08-24 | — | — | WO | disclosed |