Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTO1 | P78417 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.38 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.38 |
| ▸ | RELA | Q04206 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL28157286 | 0.84 | KDM4E (0.41) | POLBMAPTLMNAKDM4EMEN1 | |
| SCHEMBL28156802 | 0.82 | HDAC4 (0.54) | POLBMAPTLMNAMEN1KMT2A | |
| SCHEMBL28156782 | 0.82 | LMNA (0.42) | POLBMAPTLMNAKDM4EMEN1 | |
| SCHEMBL28156807 | 0.82 | MEN1 (0.53) | POLBMAPTKDM4EMEN1KMT2A | |
| SCHEMBL16337617 | 0.82 | CFTR (0.49) | GSTO1POLBMAPTLMNAKDM4E | |
| SCHEMBL28156810 | 0.81 | MAPT (0.42) | POLBMAPTLMNAMEN1KMT2A | |
| SCHEMBL28157366 | 0.80 | MAPT (0.41) | POLBMAPTLMNAKDM4EMEN1 | |
| SCHEMBL28157313 | 0.80 | RXFP1 (0.46) | POLBMAPTLMNAMEN1KMT2A | |
| SCHEMBL28157364 | 0.79 | LMNA (0.45) | POLBMAPTLMNAKDM4EMEN1 | |
| SCHEMBL28157321 | 0.77 | TP53 (0.44) | POLBMAPTLMNAKDM4EMEN1 |
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 |