Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.36 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.36 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6089725 | 0.81 | ALDH1A1 (0.33) | PARP1TNKS2 | |
| SCHEMBL6087805 | 0.78 | PDPK1 (0.30) | PARP1PARP2 | |
| SCHEMBL6091687 | 0.77 | ALDH1A1 (0.51) | — | |
| SCHEMBL6091683 | 0.77 | ALDH1A1 (0.51) | — | |
| SCHEMBL6092653 | 0.75 | SIRT1 (0.51) | PARP1TNKS2 | |
| SCHEMBL6091115 | 0.73 | — | — | |
| SCHEMBL6090843 | 0.73 | MAP4K1 (0.36) | — | |
| SCHEMBL6090841 | 0.73 | MAP4K1 (0.36) | — | |
| SCHEMBL6089357 | 0.71 | KMT2A (0.33) | — | |
| SCHEMBL6089350 | 0.71 | KMT2A (0.33) | — |
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 |