Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21645549 | 0.81 | KDM4E (0.34) | PARP1 | |
| SCHEMBL7590259 | 0.73 | NOS3 (0.37) | — | |
| SCHEMBL7597421 | 0.73 | NOS3 (0.37) | — | |
| SCHEMBL7590997 | 0.73 | NOS3 (0.37) | — | |
| SCHEMBL7596320 | 0.70 | NOS3 (0.38) | — | |
| SCHEMBL4620338 | 0.64 | — | — | |
| SCHEMBL11914737 | 0.61 | — | — | |
| SCHEMBL7600947 | 0.60 | — | — | |
| SCHEMBL3092593 | 0.60 | — | — | |
| SCHEMBL15264088 | 0.58 | NOS1 (0.50) | — |
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-1888542-A1 | SUBSTITUTED SPIRO-COMPOUNDS AND THE USE THEREOF FOR PRODUCING MEDICAMENTS | Grünenthal GmbH (DE) | 2008-02-20 | — | — | EP | disclosed |
| WO-2006136245-A1 | SUBSTITUTED SPIRO-COMPOUNDS AND THE USE THEREOF FOR PRODUCING MEDICAMENTS | Grünenthal GmbH (DE) | 2006-12-28 | — | — | WO | disclosed |