Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL4245999 | 0.96 | PARP1 (0.52) | PARP1P2RX7 | |
| SCHEMBL20544630 | 0.89 | PARP1 (0.52) | PARP1 | |
| Trifluoroacetic Acid SCHEMBL3984590 | 0.86 | PARP1 (0.52) | PARP1 | |
| SCHEMBL4541367 | 0.82 | PARP1 (0.71) | PARP1 | |
| SCHEMBL4246002 | 0.81 | P2RX7 (0.45) | PARP1P2RX7 | |
| SCHEMBL15988354 | 0.80 | PARP1 (0.57) | PARP1 | |
| SCHEMBL19005813 | 0.79 | PARP1 (0.80) | PARP1 | |
| Trifluoroacetic Acid SCHEMBL3063337 | 0.77 | PARP1 (0.53) | PARP1 | |
| SCHEMBL20544239 | 0.77 | PARP1 (0.65) | PARP1 | |
| SCHEMBL3551931 | 0.77 | PARP1 (0.60) | PARP1P2RX7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2029551-B1 | PYRIDINONE AND PYRIDAZINONE DERIVATIVES AS INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE (PARP) | MSD ITALIA SRL (IT) | 2018-10-31 | — | — | EP | claimed |