Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 4/20 | 0.54 |
| ▸ | CA2 | P00918 | 4/20 | 0.54 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 5/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.47 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1133577 | 0.78 | CA1 (0.58) | CA1CA2ABCG2MAPTKDM4E | |
| Water SCHEMBL27449135 | 0.77 | CA1 (0.56) | CA1CA2ABCG2MAPTKDM4E | |
| SCHEMBL1781415 | 0.75 | GABRP (0.48) | CA1CA2MAPTKDM4EKMT2A | |
| SCHEMBL27900112 | 0.75 | NMUR2 (0.51) | CA1CA2ABCG2MAPTKDM4E | |
| SCHEMBL29036841 | 0.74 | KDM4E (0.56) | CA1CA2ABCG2MAPTKDM4E | |
| SCHEMBL29591307 | 0.74 | CA1 (0.61) | CA1CA2ABCG2MAPTKDM4E | |
| SCHEMBL3417705 | 0.74 | CA1 (0.61) | CA1CA2ABCG2MAPTKDM4E | |
| SCHEMBL2318320 | 0.73 | CA1 (0.65) | CA1CA2ABCG2MAPTKDM4E | |
| SCHEMBL11212 | 0.73 | KDM4E (0.68) | CA1CA2ABCG2MAPTKDM4E | |
| SCHEMBL8733 | 0.73 | CA1 (0.59) | CA1CA2ABCG2MAPTKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-103508992-B | Preparation method for novel isoflavone amide derivatives and research on antioxidant activity of derivatives | UNIV BEIJING NORMAL | 2015-07-08 | — | — | CN | disclosed |
| CN-103508992-A | Preparation method for novel isoflavone amide derivatives and research on antioxidant activity of derivatives | UNIV BEIJING NORMAL | 2014-01-15 | — | — | CN | disclosed |