Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 4/20 | 0.52 |
| ▸ | RAB9A | P51151 | 4/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | IKBKB | O14920 | 3/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | JAK2 | O60674 | 2/20 | 0.47 |
| ▸ | JAK3 | P52333 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7003680 | 0.84 | KDM4E (0.63) | ALDH1A1KDM4ELMNAHPGDNPC1 | |
| SCHEMBL19494363 | 0.84 | NPC1 (0.52) | ALDH1A1KDM4ELMNAHPGDNPC1 | |
| SCHEMBL19494506 | 0.83 | NPC1 (0.49) | ALDH1A1KDM4ELMNAHPGDNPC1 | |
| SCHEMBL16246356 | 0.82 | NPC1 (0.48) | ALDH1A1KDM4ELMNAHPGDNPC1 | |
| SCHEMBL19494877 | 0.82 | NPC1 (0.50) | ALDH1A1KDM4ELMNAHPGDNPC1 | |
| SCHEMBL19494348 | 0.81 | NPC1 (0.47) | ALDH1A1KDM4ELMNAHPGDNPC1 | |
| SCHEMBL6504891 | 0.81 | IKBKB (0.57) | ALDH1A1KDM4ELMNAHPGDNPC1 | |
| SCHEMBL19494902 | 0.81 | NPC1 (0.49) | ALDH1A1KDM4ELMNAHPGDNPC1 | |
| SCHEMBL16246366 | 0.80 | LMNA (0.51) | ALDH1A1KDM4ELMNAHPGDNPC1 | |
| SCHEMBL16246509 | 0.80 | NPC1 (0.47) | ALDH1A1KDM4ELMNAHPGDNPC1 |
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-2014180562-A1 | NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF CYSTIC FIBROSIS | GALAPAGOS NV (BE) | 2014-11-13 | — | — | WO | disclosed |