Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 5/20 | 0.43 |
| ▸ | SRC | P12931 | 4/20 | 0.43 |
| ▸ | LCK | P06239 | 4/20 | 0.43 |
| ▸ | TEK | Q02763 | 4/20 | 0.43 |
| ▸ | FYN | P06241 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | ABL1 | P00519 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | LYN | P07948 | 2/20 | 0.43 |
| ▸ | BLK | P51451 | 2/20 | 0.43 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.43 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | YES1 | P07947 | 1/20 | 0.43 |
| ▸ | HCK | P08631 | 1/20 | 0.43 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.43 |
| ▸ | FGR | P09769 | 1/20 | 0.43 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.43 |
| ▸ | PRKACA | P17612 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL20162800 | 0.74 | CYP1A2 (0.41) | KDRSRCLCKTEKFYN | |
| SCHEMBL30355044 | 0.74 | CYP1A2 (0.41) | KDRSRCLCKTEKFYN | |
| SCHEMBL20162797 | 0.70 | CYP1A2 (0.40) | KDRSRCLCKTEKFYN | |
| SCHEMBL13020205 | 0.68 | CYP1A2 (0.47) | KDRSRCLCKTEKFYN | |
| SCHEMBL20162699 | 0.67 | SRC (0.48) | KDRSRCLCKTEKFYN | |
| SCHEMBL20162990 | 0.67 | FYN (0.41) | KDRSRCLCKTEKFYN | |
| SCHEMBL30892140 | 0.66 | CFTR (0.51) | KDRSRCLCKTEKFYN | |
| SCHEMBL7834490 | 0.65 | EGFR (0.56) | KDRSRCLCKTEKABL1 | |
| SCHEMBL15708850 | 0.65 | ADK (0.53) | KDRSRCLCKTEKFYN | |
| SCHEMBL4065290 | 0.64 | ADK (0.54) | KDRSRCABL1ADK |
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 |