Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 5/20 | 0.35 |
| ▸ | HSP90AB1 | P08238 | 4/20 | 0.35 |
| ▸ | F2 | P00734 | 3/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
| ▸ | PARP10 | Q53GL7 | 4/20 | 0.32 |
| ▸ | F10 | P00742 | 2/20 | 0.30 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | PARP4 | Q9UKK3 | 1/20 | 0.30 |
| ▸ | PARP15 | Q460N3 | 2/20 | 0.30 |
| ▸ | NNMT | P40261 | 1/20 | 0.30 |
| ▸ | BRD4 | O60885 | 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 | |
|---|---|---|---|---|
| SCHEMBL4531034 | 0.76 | HSP90AA1 (0.42) | HSP90AA1HSP90AB1BRD4 | |
| SCHEMBL4535495 | 0.71 | HSP90AA1 (0.51) | HSP90AA1HSP90AB1 | |
| SCHEMBL4536660 | 0.71 | KDM4E (0.44) | — | |
| SCHEMBL1702560 | 0.62 | PARP10 (0.45) | PARP10PARP2CA1CA2PARP1 | |
| SCHEMBL13351657 | 0.62 | PARP10 (0.46) | PARP10PARP2CA1CA2PARP1 | |
| Terephthalamide SCHEMBL472214 | 0.60 | PARP1 (0.60) | F2PARP10PARP2CA1CA2 | |
| Terephthalamide SCHEMBL197479 | 0.60 | PARP1 (0.60) | F2PARP10PARP2CA1CA2 | |
| Terephthalamide SCHEMBL12613686 | 0.60 | PARP1 (0.60) | F2PARP10PARP2CA1CA2 | |
| SCHEMBL23919964 | 0.60 | LMNA (0.53) | HSD11B1PARP10PARP2PARP1PARP4 | |
| SCHEMBL1090221 | 0.59 | MAOA (0.59) | BRD4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-4377942-B2 | — | — | 2009-12-02 | — | — | JP | claimed |
| JP-2008531599-A | — | — | 2008-08-14 | — | — | JP | claimed |
| EP-1856057-A1 | TETRAHYDROINDOLONE AND TETRAHYDROINDAZOLONE DERIVATIVES | Serenex, Inc. (US) | 2007-11-21 | — | — | EP | claimed |
| WO-2006091963-A1 | TETRAHYDROINDOLONE AND TETRAHYDROINDAZOLONE DERIVATIVES | SERENEX, INC. (US) | 2006-08-31 | — | — | WO | claimed |