Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 4/20 | 0.53 |
| ▸ | ERBB2 | P04626 | 4/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.53 |
| ▸ | THPO | P40225 | 2/20 | 0.53 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.53 |
| ▸ | GMNN | O75496 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.53 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.53 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL12102434 | 0.83 | EGFR (0.49) | EGFRERBB2ALDH1A1SMN1; SMN2HIF1A | |
| SCHEMBL12057871 | 0.81 | ALDH1A1 (0.71) | EGFRERBB2ALDH1A1SMN1; SMN2HIF1A | |
| SCHEMBL7472387 | 0.81 | ALDH1A1 (0.57) | EGFRERBB2ALDH1A1SMN1; SMN2HIF1A | |
| Chlorphenacyl SCHEMBL7468547 | 0.81 | LMNA (0.66) | EGFRERBB2ALDH1A1SMN1; SMN2HIF1A | |
| SCHEMBL14839588 | 0.79 | CYP3A4 (0.58) | EGFRERBB2ALDH1A1SMN1; SMN2HIF1A | |
| SCHEMBL7465257 | 0.79 | CYP4F2 (0.51) | EGFRERBB2ALDH1A1SMN1; SMN2HIF1A | |
| SCHEMBL9506408 | 0.78 | ALDH1A1 (0.58) | EGFRERBB2ALDH1A1SMN1; SMN2HIF1A | |
| SCHEMBL3282762 | 0.77 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2MAPTTSHRCYP3A4 | |
| SCHEMBL12102420 | 0.77 | HDAC6 (0.68) | EGFRERBB2ALDH1A1SMN1; SMN2HIF1A | |
| SCHEMBL20394727 | 0.76 | ALDH1A1 (0.50) | EGFRERBB2ALDH1A1SMN1; SMN2HIF1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1185526-B1 | NOVEL QUATERNARY AMMONIUM DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL USE | INST NAT SANTE RECH MED (FR) | 2004-09-15 | — | — | EP | disclosed |
| EP-1185526-A1 | NOVEL QUATERNARY AMMONIUM DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL USE | Les Laboratoires Servier (FR) | 2002-03-13 | — | — | EP | disclosed |
| WO-2001000621-A1 | NOVEL QUATERNARY AMMONIUM DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL USE | LES LABORATOIRES SERVIER (FR) | 2001-01-04 | — | — | WO | disclosed |