Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 5/20 | 0.40 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 3/20 | 0.40 |
| ▸ | RELA | Q04206 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1147536 | 0.88 | KCNH2 (0.53) | KCNH2SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL3249988 | 0.82 | KCNH2 (0.48) | KCNH2SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL3255856 | 0.81 | KCNH2 (0.47) | KCNH2SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL3256694 | 0.80 | KCNH2 (0.49) | KCNH2SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL3249035 | 0.80 | KCNH2 (0.48) | KCNH2SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL3253063 | 0.80 | ALDH1A1 (0.37) | MAPTNPC1RAB9AALDH1A1MEN1 | |
| SCHEMBL3251533 | 0.76 | KCNH2 (0.49) | KCNH2SMN1; SMN2MAPTNPC1RAB9A | |
| SCHEMBL3251048 | 0.74 | KCNH2 (0.39) | KCNH2KDM4EMAPK1 | |
| SCHEMBL3251054 | 0.74 | KCNH2 (0.39) | KCNH2KDM4EMAPK1 | |
| SCHEMBL3251051 | 0.74 | KCNH2 (0.39) | KCNH2KDM4EMAPK1 |
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 |