Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 19/20 | 0.37 |
| ▸ | PARP2 | Q9UGN5 | 4/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4766393 | 0.99 | PARP1 (0.37) | PARP1PARP2IRAK4 | |
| SCHEMBL4764698 | 0.92 | PARP1 (0.36) | PARP1PARP2IRAK4 | |
| SCHEMBL2265494 | 0.85 | PARP1 (0.36) | PARP1PARP2IRAK4 | |
| SCHEMBL2265704 | 0.85 | PARP1 (0.37) | PARP1PARP2 | |
| SCHEMBL2264305 | 0.84 | PARP1 (0.36) | PARP1PARP2IRAK4 | |
| SCHEMBL4769834 | 0.80 | PARP1 (0.40) | PARP1PARP2 | |
| SCHEMBL2265712 | 0.79 | PARP1 (0.40) | PARP1PARP2IRAK4 | |
| SCHEMBL2264141 | 0.76 | PARP1 (0.39) | PARP1PARP2IRAK4 | |
| SCHEMBL2267062 | 0.76 | PARP1 (0.38) | PARP1PARP2IRAK4 | |
| Trifluoroacetic Acid SCHEMBL27738216 | 0.76 | PARP1 (0.38) | PARP1PARP2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2007733-A1 | AMIDE SUBSTITUTED INDAZOLE AND BENZOTRIAZOLE DERIVATIVES AS POLY(ADP-RIBOSE)POLYMERASE (PARP) INHIBITORS | Istituto di Richerche di Biologia Molecolare P. Angeletti S.p.A. (IT) | 2008-12-31 | — | — | EP | disclosed |
| WO-2007113596-A1 | AMIDE SUBSTITUTED INDAZOLE AND BENZOTRIAZOLE DERIVATIVES AS POLY(ADP-RIBOSE)POLYMERASE (PARP) INHIBITORS | ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) | 2007-10-11 | — | — | WO | disclosed |