Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTOR | P42345 | 3/20 | 0.33 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.33 |
| ▸ | TEK | Q02763 | 3/20 | 0.32 |
| ▸ | EGFR | P00533 | 3/20 | 0.32 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.32 |
| ▸ | ERBB3 | P21860 | 1/20 | 0.32 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.32 |
| ▸ | RET | P07949 | 7/20 | 0.32 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.31 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.31 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.31 |
| ▸ | PIK3CD | O00329 | 3/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.31 |
| ▸ | PIK3CB | P42338 | 3/20 | 0.31 |
| ▸ | PIK3CG | P48736 | 3/20 | 0.31 |
| ▸ | PRKDC | P78527 | 3/20 | 0.31 |
| ▸ | NEK7 | Q8TDX7 | 1/20 | 0.30 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.30 |
| ▸ | KDR | P35968 | 4/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20181904 | 0.93 | PDPK1 (0.36) | PDPK1TEKEGFRERBB2ERBB3 | |
| SCHEMBL20181907 | 0.91 | EGFR (0.35) | MTORPDPK1AKT1TEKEGFR | |
| SCHEMBL20182202 | 0.90 | — | — | |
| SCHEMBL20182234 | 0.82 | EGFR (0.35) | PDPK1TEKEGFRERBB2ERBB3 | |
| SCHEMBL20182283 | 0.79 | NTRK1 (0.36) | MTORPDPK1AKT1TEKEGFR | |
| SCHEMBL20182228 | 0.78 | KDR (0.45) | MTORTEKEGFRKDRSRC | |
| SCHEMBL20182362 | 0.78 | CFTR (0.40) | TEKEGFRRETPIK3CDPIK3CA | |
| SCHEMBL20182200 | 0.77 | KDR (0.39) | TEKPIK3CDPIK3CAPIK3CBPIK3CG | |
| SCHEMBL20182274 | 0.77 | EIF2AK3 (0.40) | TEKEGFRRETPIK3CDPIK3CA | |
| SCHEMBL20182241 | 0.76 | KDR (0.46) | MTORTEKEGFRPIK3CDPIK3CA |
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 |