Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | TP53 | P04637 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.51 |
| ▸ | PSMB11 | A5LHX3 | 1/20 | 0.51 |
| ▸ | PSMA7 | O14818 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | FOXO3 | O43524 | 1/20 | 0.51 |
| ▸ | MITF | O75030 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.51 |
| ▸ | PSMA1 | P25786 | 1/20 | 0.51 |
| ▸ | PSMA2 | P25787 | 1/20 | 0.51 |
| ▸ | PSMA3 | P25788 | 1/20 | 0.51 |
| ▸ | PSMA4 | P25789 | 1/20 | 0.51 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.51 |
| ▸ | PSMB9 | P28065 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL28391264 | 0.83 | TXNRD1 (0.52) | ALDH1A1TP53SMN1; SMN2LMNACYP1A2 | |
| SCHEMBL21001896 | 0.79 | ALDH1A1 (0.52) | ALDH1A1TP53SMN1; SMN2LMNACYP1A2 | |
| SCHEMBL22713053 | 0.79 | ALDH1A1 (0.52) | ALDH1A1TP53SMN1; SMN2LMNACYP1A2 | |
| SCHEMBL21002238 | 0.78 | ALDH1A1 (0.52) | ALDH1A1TP53SMN1; SMN2LMNACYP1A2 | |
| SCHEMBL21002098 | 0.78 | ALDH1A1 (0.52) | ALDH1A1TP53SMN1; SMN2LMNACYP1A2 | |
| SCHEMBL28384658 | 0.77 | ALDH1A1 (0.51) | ALDH1A1TP53SMN1; SMN2LMNACYP1A2 | |
| SCHEMBL28389884 | 0.77 | IDO1 (0.51) | ALDH1A1TP53SMN1; SMN2LMNACYP1A2 | |
| SCHEMBL15422627 | 0.77 | ALDH1A1 (0.57) | ALDH1A1TP53SMN1; SMN2LMNACYP1A2 | |
| SCHEMBL15422630 | 0.77 | ALDH1A1 (0.57) | ALDH1A1TP53SMN1; SMN2LMNACYP1A2 | |
| SCHEMBL17459697 | 0.75 | IDO1 (0.55) | ALDH1A1TP53SMN1; SMN2LMNACYP1A2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107382966-B | Piperlongumine-ligustrazine heterocomplex, preparation method and medical application | 中国药科大学 | 2020-04-28 | — | — | CN | disclosed |