Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 9/20 | 0.47 |
| ▸ | LMNA | P02545 | 8/20 | 0.47 |
| ▸ | MEN1 | O00255 | 8/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.47 |
| ▸ | HTT | P42858 | 7/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.47 |
| ▸ | TP53 | P04637 | 6/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 9/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | RCE1 | Q9Y256 | 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 | |
|---|---|---|---|---|
| SCHEMBL28157284 | 0.85 | LMNA (0.44) | NPC1LMNAMEN1KMT2AHTT | |
| SCHEMBL28156717 | 0.84 | MEN1 (0.50) | NPC1LMNAMEN1KMT2AHTT | |
| SCHEMBL30692333 | 0.79 | NPC1 (0.56) | NPC1LMNAMEN1KMT2AHTT | |
| SCHEMBL30692334 | 0.79 | NPC1 (0.56) | NPC1LMNAMEN1KMT2AHTT | |
| SCHEMBL704075 | 0.77 | STAT3 (0.58) | NPC1LMNAMEN1KMT2AHTT | |
| SCHEMBL31426452 | 0.77 | STAT3 (0.58) | NPC1LMNAMEN1KMT2AHTT | |
| SCHEMBL28157411 | 0.76 | KDM1A (0.55) | LMNAMEN1KMT2AHSD17B10KDM4E | |
| SCHEMBL16246469 | 0.75 | CFTR (0.44) | NPC1LMNAMEN1KMT2AHTT | |
| SCHEMBL7336707 | 0.74 | LMNA (0.54) | NPC1LMNAMEN1KMT2AHTT | |
| SCHEMBL2701214 | 0.72 | LMNA (0.67) | NPC1LMNAMEN1KMT2AHTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-105531268-B | Noval chemical compound and its pharmaceutical composition for treating cystic fibrosis | 加拉佩格斯股份有限公司 | 2017-09-12 | — | — | CN | disclosed |