Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOD1 | Q9Y239 | 10/20 | 0.69 |
| ▸ | CXCL8 | P10145 | 4/20 | 0.69 |
| ▸ | NOD2 | Q9HC29 | 2/20 | 0.56 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL14247143 | 0.82 | NOD1 (1.00) | NOD1CXCL8NOD2ALDH3A1GAA | |
| SCHEMBL11156270 | 0.78 | NOD1 (0.57) | NOD1CXCL8NOD2ALDH3A1GAA | |
| SCHEMBL11156272 | 0.78 | NOD1 (0.57) | NOD1CXCL8NOD2ALDH3A1GAA | |
| SCHEMBL5991067 | 0.76 | SMN1; SMN2 (0.56) | NOD1CXCL8NOD2ALDH3A1GAA | |
| SCHEMBL11167751 | 0.76 | NOD1 (0.59) | NOD1CXCL8NOD2ALDH3A1GAA | |
| SCHEMBL11167754 | 0.76 | NOD1 (0.59) | NOD1CXCL8NOD2ALDH3A1GAA | |
| SCHEMBL991522 | 0.76 | PI4KB (0.57) | PI4KBMAPK14CYP3A4 | |
| SCHEMBL989419 | 0.76 | MAPK14 (0.49) | NOD1CXCL8NOD2ALDH3A1GAA | |
| SCHEMBL14247717 | 0.76 | MAPK14 (0.45) | NOD1CXCL8NOD2ALDH3A1GAA | |
| SCHEMBL11148706 | 0.75 | NOD1 (0.57) | NOD1CXCL8NOD2ALDH3A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012174312-A2 | BENZIMIDAZOLE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-12-20 | — | — | WO | disclosed |
| WO-2012174312-A2 | BENZIMIDAZOLE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-12-20 | — | — | WO | disclosed |