Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT2 | Q8IXJ6 | 2/20 | 0.47 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.45 |
| ▸ | NAMPT | P43490 | 1/20 | 0.43 |
| ▸ | TOP2A | P11388 | 1/20 | 0.42 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.42 |
| ▸ | AURKA | O14965 | 1/20 | 0.42 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.42 |
| ▸ | GLS | O94925 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | NPY1R | P25929 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4486676 | 0.81 | AGTR2 (0.52) | CYP17A1 | |
| SCHEMBL29264682 | 0.78 | NAMPT (0.47) | NAMPTBRD4MEN1MAPTKMT2A | |
| SCHEMBL28309370 | 0.77 | SIRT2 (0.52) | SIRT2CYP17A1TOP2ATOP2BAURKA | |
| SCHEMBL18213795 | 0.76 | SIRT2 (0.52) | SIRT2CYP17A1NAMPTTOP2ATOP2B | |
| SCHEMBL14305094 | 0.76 | SIRT2 (0.52) | SIRT2CYP17A1TOP2ATOP2BAURKA | |
| SCHEMBL12016594 | 0.75 | MMP1 (0.47) | ALDH1A1MAPTMGLLIDO1POLB | |
| SCHEMBL432657 | 0.74 | KMT2A (0.49) | MEN1ALDH1A1LMNAKMT2AMGLL | |
| SCHEMBL27498370 | 0.73 | CYP3A4 (0.50) | SIRT2CYP17A1NAMPTAURKARPS6KB1 | |
| SCHEMBL6079210 | 0.73 | SIRT2 (0.51) | SIRT2CYP17A1NAMPTAURKARPS6KB1 | |
| SCHEMBL31139283 | 0.73 | SIRT2 (0.50) | SIRT2CYP17A1NAMPTTOP2ATOP2B |
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-111944140-B | Polymeric prodrug micelle with reduction responsiveness and preparation method and application thereof | 南开大学 | 2022-06-10 | — | — | CN | disclosed |
| CN-111944140-A | Polymeric prodrug micelle with reduction responsiveness and preparation method and application thereof | 南开大学 | 2020-11-17 | — | — | CN | disclosed |