Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 20/20 | 1.00 |
| ▸ | ABL1 | P00519 | 13/20 | 0.72 |
| ▸ | ABL2 | P42684 | 6/20 | 0.72 |
| ▸ | CDK1 | P06493 | 5/20 | 0.64 |
| ▸ | PRKCA | P17252 | 6/20 | 0.56 |
| ▸ | SRC | P12931 | 3/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL7496140 | 0.90 | EGFR (0.82) | EGFRABL1ABL2CDK1PRKCA | |
| Bromide SCHEMBL7495577 | 0.89 | EGFR (0.80) | EGFRABL1ABL2CDK1PRKCA | |
| Hydrochloric Acid SCHEMBL7499025 | 0.89 | EGFR (0.80) | EGFRABL1ABL2CDK1PRKCA | |
| SCHEMBL2461507 | 0.88 | EGFR (0.78) | EGFRABL1ABL2CDK1PRKCA | |
| SCHEMBL2462851 | 0.87 | EGFR (1.00) | EGFRABL1ABL2CDK1PRKCA | |
| SCHEMBL7491384 | 0.85 | EGFR (0.74) | EGFRABL1ABL2CDK1PRKCA | |
| SCHEMBL2463632 | 0.84 | EGFR (1.00) | EGFRABL1ABL2PRKCA | |
| SCHEMBL29406611 | 0.84 | EGFR (1.00) | EGFRABL1ABL2PRKCA | |
| SCHEMBL2464688 | 0.84 | EGFR (1.00) | EGFRABL1ABL2CDK1PRKCA | |
| SCHEMBL7495082 | 0.83 | EGFR (0.70) | EGFRABL1ABL2CDK1PRKCA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2041137-B1 | PYRROLOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS | BOEHRINGER INGELHEIM INT (DE) | 2011-09-28 | — | — | EP | claimed |
| EP-2041137-B1 | PYRROLOPYRIMIDINES FOR PHARMACEUTICAL COMPOSITIONS | BOEHRINGER INGELHEIM INT (DE) | 2011-09-28 | — | — | EP | disclosed |