Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 6/20 | 0.37 |
| ▸ | KDR | P35968 | 6/20 | 0.37 |
| ▸ | RET | P07949 | 4/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 4/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.33 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.33 |
| ▸ | PRKDC | P78527 | 2/20 | 0.33 |
| ▸ | SRC | P12931 | 4/20 | 0.33 |
| ▸ | GRM5 | P41594 | 1/20 | 0.33 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | TEK | Q02763 | 1/20 | 0.33 |
| ▸ | ADK | P55263 | 1/20 | 0.32 |
| ▸ | PIK3R1 | P27986 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
| ▸ | HCK | P08631 | 1/20 | 0.32 |
| ▸ | MTOR | P42345 | 1/20 | 0.32 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20162832 | 0.89 | CFTR (0.37) | CFTRKDRRETPIK3CDPIK3CA | |
| SCHEMBL20163012 | 0.85 | KDR (0.44) | CFTRKDRRETPIK3CDPIK3CA | |
| SCHEMBL20162981 | 0.80 | KDR (0.45) | KDRSRCLCKTEKABL1 | |
| SCHEMBL20173319 | 0.77 | CFTR (0.49) | CFTRKDRRETSRCLCK | |
| SCHEMBL20162765 | 0.75 | CFTR (0.49) | CFTRKDRRETSRCLCK | |
| SCHEMBL30037943 | 0.75 | CFTR (0.49) | CFTRKDRRETSRCLCK | |
| SCHEMBL30538123 | 0.74 | CFTR (0.45) | CFTRKDRRETPIK3CDPIK3CA | |
| SCHEMBL20162851 | 0.74 | CFTR (0.45) | CFTRKDRRETPIK3CDPIK3CA | |
| SCHEMBL27208127 | 0.74 | SRC (0.51) | CFTRKDRRETPIK3CDPIK3CA | |
| SCHEMBL20162611 | 0.72 | CFTR (0.46) | CFTRKDRRETPI4KB |
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-2018094137-A1 | PYRROLOPYRIMIDINES AS CFTR POTENTIATORS | CYSTIC FIBROSIS FOUNDATION THERAPEUTICS INC. (US) | 2018-05-24 | — | — | WO | disclosed |