Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 2/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.31 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
| ▸ | CASP3 | P42574 | 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 | |
|---|---|---|---|---|
| SCHEMBL3309357 | 0.79 | TNF (0.45) | TNFCASP3 | |
| SCHEMBL4432786 | 0.78 | BACE1 (0.38) | BACE1CASP3 | |
| SCHEMBL27042592 | 0.71 | CASP3 (0.35) | BACE1CASP3 | |
| SCHEMBL7433217 | 0.70 | MDM2 (0.34) | BACE1CASP3 | |
| SCHEMBL5509899 | 0.69 | SIRT2 (0.32) | BACE1CASP3 | |
| SCHEMBL5508568 | 0.68 | BACE1 (0.31) | BACE1 | |
| SCHEMBL3308937 | 0.67 | CA12 (0.32) | PTGS2 | |
| SCHEMBL22444661 | 0.66 | NPSR1 (0.34) | BACE1CASP3 | |
| SCHEMBL22454832 | 0.66 | NPSR1 (0.34) | BACE1CASP3 | |
| SCHEMBL22444662 | 0.66 | NPSR1 (0.34) | BACE1CASP3 |
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-2125695-A2 | NITRIC OXIDE DONOR COMPOUNDS | Nicox S.A. (FR) | 2009-12-02 | — | — | EP | disclosed |
| WO-2008095841-A2 | NITRIC OXIDE DONOR COMPOUNDS | NICOX S.A. (FR) | 2008-08-14 | — | — | WO | disclosed |