Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 7/20 | 0.53 |
| ▸ | PARP2 | Q9UGN5 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | CNR1 | P21554 | 2/20 | 0.44 |
| ▸ | CNR2 | P34972 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | PARP3 | Q9Y6F1 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7526237 | 0.92 | PARP1 (0.54) | PARP1PARP2ALDH1A1KDM4ECNR1 | |
| SCHEMBL487963 | 0.87 | ALDH1A1 (0.56) | PARP1PARP2ALDH1A1KDM4EKMT2A | |
| SCHEMBL18108811 | 0.86 | PARP1 (0.53) | PARP1PARP2ALDH1A1KDM4ECNR1 | |
| SCHEMBL18040375 | 0.83 | PARP1 (0.57) | PARP1PARP2ALDH1A1KDM4ECNR1 | |
| SCHEMBL16462030 | 0.83 | ALDH1A1 (0.51) | PARP1PARP2ALDH1A1KDM4ECNR1 | |
| SCHEMBL1385121 | 0.80 | PARP1 (0.54) | PARP1PARP2ALDH1A1KDM4EKMT2A | |
| SCHEMBL5795349 | 0.78 | KDM4E (0.52) | ALDH1A1KDM4ECNR1CNR2KMT2A | |
| SCHEMBL7561192 | 0.78 | CYP1A2 (0.54) | PARP1ALDH1A1KDM4EKMT2AMAPT | |
| SCHEMBL6043506 | 0.77 | ALDH1A1 (0.55) | ALDH1A1KMT2AMAPTMEN1 | |
| SCHEMBL3373579 | 0.77 | PARP1 (0.50) | PARP1PARP2ALDH1A1KDM4ECNR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002020437-A2 | BASIC COMPOUNDS CONTAINING TERTIARY AMIDES WITH ACTIVITY ON TACHYKININ RECEPTORS, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | MENARINI RICERCHE S.P.A. (IT) | 2002-03-14 | — | — | WO | disclosed |