Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | ESR1 | P03372 | 3/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.45 |
| ▸ | EDNRB | P24530 | 1/20 | 0.44 |
| ▸ | EDNRA | P25101 | 1/20 | 0.44 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.43 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL2070035 | 1.00 | CYP3A4 (0.53) | CYP3A4ESR1ESR2USP2ALDH1A1 | |
| SCHEMBL2070036 | 1.00 | CYP3A4 (0.53) | CYP3A4ESR1ESR2USP2ALDH1A1 | |
| SCHEMBL19418882 | 0.91 | CYP3A4 (0.54) | CYP3A4USP2ALDH1A1ALOX15ALOX12 | |
| SCHEMBL12255070 | 0.87 | CYP3A4 (0.49) | CYP3A4ESR1ESR2MAOBMAOA | |
| SCHEMBL2070165 | 0.87 | CYP3A4 (0.49) | CYP3A4ESR1ESR2MAOBMAOA | |
| SCHEMBL133493 | 0.87 | CYP3A4 (0.49) | CYP3A4ESR1ESR2MAOBMAOA | |
| SCHEMBL14076891 | 0.87 | CYP3A4 (0.49) | CYP3A4ESR1ESR2MAOBMAOA | |
| SCHEMBL149887 | 0.87 | CYP3A4 (0.49) | CYP3A4ESR1ESR2MAOBMAOA | |
| SCHEMBL6092580 | 0.87 | CYP3A4 (0.54) | CYP3A4ESR1ESR2USP2ALDH1A1 | |
| SCHEMBL20831831 | 0.87 | ESR1 (0.58) | CYP3A4ESR1ESR2ALDH1A1ALOX15 |
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-1153020-A4 | PRODUCTION OF ISOFLAVONE DERIVATIVES | NOVOGEN RES PTY LTD (AU) | 2002-08-21 | — | — | EP | disclosed |
| EP-1153020-A1 | PRODUCTION OF ISOFLAVONE DERIVATIVES | Novogen Research Pty. Ltd. (AU) | 2001-11-14 | — | — | EP | disclosed |
| WO-2000049009-A1 | PRODUCTION OF ISOFLAVONE DERIVATIVES | NOVOGEN RESEARCH PTY. LTD. (AU) | 2000-08-24 | — | — | WO | disclosed |