Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 17/20 | 0.52 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6091496 | 1.00 | KDR (0.52) | KDRCHEK1CHRNB2CHRNA4 | |
| SCHEMBL6092488 | 0.85 | KDR (0.42) | KDRCHRNB2CHRNA4 | |
| SCHEMBL6092492 | 0.85 | KDR (0.42) | KDRCHRNB2CHRNA4 | |
| SCHEMBL6089006 | 0.84 | KDR (0.41) | KDRCHRNB2CHRNA4 | |
| SCHEMBL6089010 | 0.84 | KDR (0.41) | KDRCHRNB2CHRNA4 | |
| SCHEMBL6091900 | 0.84 | KDR (0.43) | KDRCHRNB2CHRNA4 | |
| SCHEMBL6091902 | 0.84 | KDR (0.43) | KDRCHRNB2CHRNA4 | |
| SCHEMBL6088996 | 0.83 | KDR (0.39) | KDRCHRNB2CHRNA4 | |
| SCHEMBL6088991 | 0.83 | KDR (0.39) | KDRCHRNB2CHRNA4 | |
| SCHEMBL6090104 | 0.82 | KDR (0.42) | KDRCHRNB2CHRNA4 |
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-7060822-B1 | 2-pyrazolin-5-ones | ABBOTT GMBH & CO. KG (DE) | 2006-06-13 | — | — | US | disclosed |