Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | CLK1 | P49759 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | PDGFRA | P16234 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | KIT | P10721 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.44 |
| ▸ | RELA | Q04206 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1147533 | 0.88 | KCNH2 (0.60) | KCNH2ALDH1A1MAPTHTTCLK1 | |
| SCHEMBL3256178 | 0.87 | SMN1; SMN2 (0.49) | ALDH1A1MAPTHTTNPSR1MEN1 | |
| SCHEMBL3249031 | 0.87 | ALDH1A1 (0.44) | ALDH1A1MAPTHTTNPSR1KMT2A | |
| SCHEMBL3247108 | 0.87 | MAPT (0.51) | KCNH2ALDH1A1MAPTHTTCLK1 | |
| SCHEMBL3253530 | 0.81 | KCNH2 (0.52) | KCNH2ALDH1A1MAPTHTTCLK1 | |
| SCHEMBL3251532 | 0.80 | MAOA (0.46) | KCNH2ALDH1A1PDGFRAKITLMNA | |
| SCHEMBL1147940 | 0.78 | MAPT (0.51) | KCNH2ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL1147941 | 0.78 | MAPT (0.51) | KCNH2ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL3254277 | 0.77 | KCNH2 (0.48) | KCNH2ALDH1A1MAPTHTTCLK1 | |
| SCHEMBL13286290 | 0.77 | KCNH2 (0.75) | KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2001478-B1 | CYCLOHEXYL OR PIPERIDINYL CARBOXAMIDE ANTIBIOTIC DERIVATIVES | ACTELION PHARMACEUTICALS LTD (CH) | 2010-06-02 | — | — | EP | claimed |