Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.46 |
| ▸ | USP8 | P40818 | 1/20 | 0.45 |
| ▸ | USP7 | Q93009 | 1/20 | 0.45 |
| ▸ | USP47 | Q96K76 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | MALT1 | Q9UDY8 | 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 | |
|---|---|---|---|---|
| SCHEMBL9243687 | 1.00 | CYP1A2 (0.46) | CYP1A2CYP2A6USP8USP7USP47 | |
| SCHEMBL1486137 | 0.94 | CYP1A2 (0.52) | CYP1A2CYP2A6USP8USP7USP47 | |
| SCHEMBL1486146 | 0.94 | CYP1A2 (0.52) | CYP1A2CYP2A6USP8USP7USP47 | |
| SCHEMBL9557861 | 0.90 | CYP1A2 (0.56) | CYP1A2CYP2A6USP8USP7MAOA | |
| SCHEMBL3717126 | 0.88 | CYP1A2 (0.64) | CYP1A2CYP2A6USP8USP7USP47 | |
| SCHEMBL9239569 | 0.88 | CYP1A2 (0.52) | CYP1A2CYP2A6USP8USP7USP47 | |
| SCHEMBL9328908 | 0.87 | CA1 (0.52) | CYP1A2USP8USP7USP47CA1 | |
| SCHEMBL9811010 | 0.82 | CA1 (0.48) | CYP1A2USP8USP7USP47CA1 | |
| SCHEMBL30479662 | 0.82 | CA1 (0.52) | CYP1A2USP8USP7USP47CA1 | |
| SCHEMBL7432075 | 0.82 | CA1 (0.52) | CYP1A2USP8USP7USP47CA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0344110-B1 | SUBSTITUTED NAPHTHACENES-5,12-DIONES AND THEIR USE | CIBA-GEIGY AG (CH) | 1992-09-16 | — | — | EP | disclosed |
| US-5001243-A | Substituted naphthacene-5, 12-diones | CIBA-GEIGY CORPORATION (US) | 1991-03-19 | — | — | US | disclosed |
| EP-0344110-A2 | Substituted naphthacenes-5,12-diones and their use | CIBA-GEIGY AG (CH) | 1989-11-29 | — | — | EP | disclosed |