Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NQO1 | P15559 | 3/20 | 1.00 |
| ▸ | POR | P16435 | 3/20 | 1.00 |
| ▸ | MALT1 | Q9UDY8 | 2/20 | 0.50 |
| ▸ | IDO1 | P14902 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | USP8 | P40818 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | STAT3 | P40763 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| (3R)-Dunnione SCHEMBL29468606 | 0.78 | NQO1 (0.63) | NQO1PORMALT1IDO1ALDH1A1 | |
| (3R)-Dunnione SCHEMBL6052903 | 0.72 | NQO1 (0.56) | NQO1PORMALT1IDO1ALDH1A1 | |
| SCHEMBL23111388 | 0.72 | CA1 (0.57) | NQO1PORMALT1IDO1CA1 | |
| SCHEMBL29595732 | 0.72 | CA1 (0.57) | NQO1PORMALT1IDO1CA1 | |
| SCHEMBL29199282 | 0.71 | STAT3 (0.67) | NQO1PORMALT1IDO1USP8 | |
| SCHEMBL8260282 | 0.69 | NQO1 (0.52) | NQO1PORMALT1IDO1ALDH1A1 | |
| SCHEMBL2993382 | 0.69 | CA1 (0.53) | NQO1PORMALT1IDO1CA1 | |
| SCHEMBL7451901 | 0.68 | CA1 (0.57) | IDO1CA1CA2CA4CA7 | |
| SCHEMBL2252533 | 0.68 | CA1 (0.57) | IDO1CA1CA2CA4CA7 | |
| SCHEMBL30629120 | 0.68 | CA1 (0.57) | NQO1PORIDO1CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7253207-B2 | Quinones as disease therapies | CELLGATE, INC. (US) | 2007-08-07 | — | — | US | disclosed |
| US-7253207-B2 | Quinones as disease therapies | CELLGATE, INC. (US) | 2007-08-07 | — | — | US | disclosed |