Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 20/20 | 0.57 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.54 |
| ▸ | ERBB3 | P21860 | 1/20 | 0.54 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL19103353 | 0.92 | EGFR (0.67) | EGFRERBB2ERBB3ERBB4 | |
| SCHEMBL19103343 | 0.92 | EGFR (0.64) | EGFRERBB2ERBB3ERBB4KCNH2 | |
| SCHEMBL19320679 | 0.92 | EGFR (0.53) | EGFRERBB2ERBB3ERBB4 | |
| SCHEMBL19320677 | 0.89 | EGFR (0.59) | EGFRERBB2ERBB3ERBB4KCNH2 | |
| SCHEMBL19103315 | 0.88 | EGFR (0.47) | EGFRERBB2ERBB3ERBB4KCNH2 | |
| SCHEMBL19103323 | 0.86 | EGFR (0.65) | EGFRERBB2ERBB3ERBB4KCNH2 | |
| SCHEMBL19103256 | 0.86 | EGFR (0.65) | EGFRERBB2ERBB3ERBB4KCNH2 | |
| SCHEMBL19103272 | 0.86 | EGFR (0.51) | EGFRERBB2ERBB3ERBB4 | |
| SCHEMBL17384966 | 0.86 | EGFR (0.62) | EGFRERBB2ERBB3ERBB4KCNH2 | |
| SCHEMBL19103351 | 0.86 | EGFR (0.57) | EGFRERBB2ERBB3ERBB4KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9796712-B2 | Heteroaryl compounds for kinase inhibition | ARIAD PHARMACEUTICALS, INC. (US) | 2017-10-24 | — | — | US | disclosed |