Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.68 |
| ▸ | MMP1 | P03956 | 1/20 | 0.68 |
| ▸ | FOS | P01100 | 1/20 | 0.62 |
| ▸ | TTR | P02766 | 1/20 | 0.62 |
| ▸ | JUN | P05412 | 1/20 | 0.62 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.62 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.62 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.62 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.57 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.57 |
| ▸ | TSHR | P16473 | 3/20 | 0.51 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.50 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL20402988 | 0.90 | MMP1 (0.66) | CYP3A4MMP1FOSTTRJUN | |
| SCHEMBL20402959 | 0.84 | CYP3A4 (0.85) | CYP3A4MMP1FOSTTRJUN | |
| (+)-Secoisolariciresinol SCHEMBL31677395 | 0.81 | CYP3A4 (1.00) | CYP3A4MMP1FOSTTRJUN | |
| (+)-Secoisolariciresinol SCHEMBL29363814 | 0.81 | CYP3A4 (1.00) | CYP3A4MMP1FOSTTRJUN | |
| (+)-Secoisolariciresinol SCHEMBL30334899 | 0.81 | CYP3A4 (1.00) | CYP3A4MMP1FOSTTRJUN | |
| (+)-Secoisolariciresinol SCHEMBL29617981 | 0.81 | CYP3A4 (1.00) | CYP3A4MMP1FOSTTRJUN | |
| (+)-Secoisolariciresinol SCHEMBL325398 | 0.81 | CYP3A4 (1.00) | CYP3A4MMP1FOSTTRJUN | |
| (+)-Secoisolariciresinol SCHEMBL30605875 | 0.81 | CYP3A4 (1.00) | CYP3A4MMP1FOSTTRJUN | |
| (+)-Secoisolariciresinol SCHEMBL21028109 | 0.81 | CYP3A4 (1.00) | CYP3A4MMP1FOSTTRJUN | |
| (+)-Secoisolariciresinol SCHEMBL20402961 | 0.81 | CYP3A4 (1.00) | CYP3A4MMP1FOSTTRJUN |
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 |
|---|---|---|---|---|---|---|---|
| CN-113956229-B | Lignan compound in lilac and preparation method and application thereof | 江西中医药大学 | 2022-03-08 | — | — | CN | claimed |
| CN-113956229-B | Lignan compound in lilac and preparation method and application thereof | 江西中医药大学 | 2022-03-08 | — | — | CN | disclosed |
| CN-113956229-B | Lignan compound in lilac and preparation method and application thereof | 江西中医药大学 | 2022-03-08 | — | — | CN | disclosed |