Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 4/20 | 1.00 |
| ▸ | KDR | P35968 | 14/20 | 0.67 |
| ▸ | MET | P08581 | 12/20 | 0.67 |
| ▸ | EGFR | P00533 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8893650 | 0.99 | ERBB2 (0.98) | ERBB2KDRMETEGFR | |
| SCHEMBL8558469 | 0.92 | ERBB2 (0.85) | ERBB2KDRMETEGFR | |
| Hydrochloric Acid SCHEMBL8893639 | 0.91 | ERBB2 (0.84) | ERBB2KDRMETEGFR | |
| SCHEMBL8555757 | 0.85 | ERBB2 (1.00) | ERBB2KDREGFR | |
| Hydrochloric Acid SCHEMBL8894722 | 0.84 | ERBB2 (0.98) | ERBB2KDREGFR | |
| SCHEMBL7126252 | 0.83 | ERBB2 (0.70) | ERBB2EGFR | |
| SCHEMBL7119441 | 0.83 | ERBB2 (0.70) | ERBB2EGFR | |
| SCHEMBL6483328 | 0.80 | ERBB2 (0.67) | ERBB2KDRMETEGFR | |
| SCHEMBL4354490 | 0.78 | ERBB2 (0.68) | ERBB2KDRMETEGFR | |
| SCHEMBL8933881 | 0.78 | ERBB2 (0.73) | ERBB2KDREGFR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0843671-A1 | HETEROCYCLIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | GLAXO GROUP LIMITED (GB) | 1998-05-27 | — | — | EP | claimed |
| WO-1997003069-A1 | HETEROCYCLIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | GLAXO GROUP LIMITED (GB) | 1997-01-30 | — | — | WO | claimed |
| EP-0843671-A1 | HETEROCYCLIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | GLAXO GROUP LIMITED (GB) | 1998-05-27 | — | — | EP | disclosed |
| WO-1997003069-A1 | HETEROCYCLIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | GLAXO GROUP LIMITED (GB) | 1997-01-30 | — | — | WO | disclosed |