Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.70 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.69 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 1/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | CNR1 | P21554 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL2285784 | 0.84 | ALDH1A1 (0.76) | NPC1EPHX2SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL20240865 | 0.81 | ALDH1A1 (0.72) | NPC1EPHX2SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL8091601 | 0.80 | EPHX2 (0.88) | EPHX2ALDH1A1GAAMEN1KMT2A | |
| Zinc Ion SCHEMBL9443922 | 0.80 | NPC1 (0.63) | NPC1EPHX2SMN1; SMN2ALDH1A1GAA | |
| SCHEMBL28224185 | 0.78 | ALDH1A1 (0.66) | EPHX2MAPTALDH1A1KDM4EGAA | |
| SCHEMBL3917592 | 0.78 | NPC1 (0.64) | NPC1EPHX2SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL10154252 | 0.78 | ALDH1A1 (0.69) | NPC1EPHX2SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL12101129 | 0.78 | PKM (0.75) | NPC1EPHX2SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL12376703 | 0.77 | TP53 (0.79) | NPC1EPHX2SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL2015601 | 0.77 | GAA (0.61) | NPC1EPHX2ALDH1A1KDM4EGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-5070087-A | Aryl(alkyland alkylene)-N-((phenoxy and phenylthio)alkyl) aminoheterocyclics as cardiovascular, anthihistaminic, antisecretory and antiallergy agents | A. H. ROBINS COMPANY, INCORPORATED (US) | 1991-12-03 | — | — | US | disclosed |
| US-4950674-A | Arylalkylheterocyclic amines,N-substituted by aryloxyalkyl group in a method for allergy treatment | A. H. ROBINS COMPANY, INCORPORATED (US) | 1990-08-21 | — | — | US | disclosed |