Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.39 |
| ▸ | IKBKB | O14920 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | RORC | P51449 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16338098 | 0.79 | CFTR (0.48) | NPC1RAB9AMAPK10IKBKBKDM4E | |
| SCHEMBL16261720 | 0.74 | RAB9A (0.47) | NPC1RAB9AIKBKBKDM4EALDH1A1 | |
| SCHEMBL19494428 | 0.74 | RORC (0.42) | NPC1RAB9AIKBKBKDM4EALDH1A1 | |
| SCHEMBL16263912 | 0.74 | BCL3 (0.42) | NPC1RAB9AIKBKBALDH1A1MAPT | |
| SCHEMBL19494729 | 0.74 | NPC1 (0.42) | NPC1RAB9AMAPK10IKBKBKDM4E | |
| SCHEMBL19494912 | 0.74 | CFTR (0.40) | NPC1RAB9AMAPK10KDM4EALDH1A1 | |
| SCHEMBL16263736 | 0.73 | CFTR (0.45) | NPC1RAB9AMAPK10IKBKBKDM4E | |
| SCHEMBL16263847 | 0.73 | NPC1 (0.42) | NPC1RAB9AMAPK10IKBKBKDM4E | |
| SCHEMBL16263849 | 0.73 | CNR2 (0.42) | NPC1RAB9AALDH1A1MAPTLMNA | |
| SCHEMBL19494315 | 0.71 | NPC1 (0.43) | NPC1RAB9AIKBKBKDM4EALDH1A1 |
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-2994463-B1 | NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF CYSTIC FIBROSIS | GALAPAGOS NV (BE) | 2017-10-25 | — | — | EP | disclosed |