Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.65 |
| ▸ | TP53 | P04637 | 1/20 | 0.65 |
| ▸ | POLB | P06746 | 1/20 | 0.65 |
| ▸ | FPR2 | P25090 | 1/20 | 0.61 |
| ▸ | BACE1 | P56817 | 2/20 | 0.56 |
| ▸ | IDO1 | P14902 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | MTOR | P42345 | 1/20 | 0.53 |
| ▸ | STAT3 | P40763 | 1/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | CIT | O14578 | 1/20 | 0.50 |
| ▸ | AKT1 | P31749 | 1/20 | 0.50 |
| ▸ | NAMPT | P43490 | 1/20 | 0.49 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL21880198 | 1.00 | MAPT (0.65) | MAPTTP53POLBFPR2BACE1 | |
| SCHEMBL21529039 | 0.89 | KIF11 (0.57) | MAPTTP53POLBFPR2MTOR | |
| SCHEMBL21529038 | 0.89 | KIF11 (0.57) | MAPTTP53POLBFPR2MTOR | |
| SCHEMBL3277354 | 0.88 | TACR1 (0.60) | MAPTTP53POLBFPR2BACE1 | |
| SCHEMBL3277359 | 0.88 | TACR1 (0.60) | MAPTTP53POLBFPR2BACE1 | |
| SCHEMBL28085622 | 0.86 | BACE1 (0.56) | MAPTTP53POLBBACE1NPC1 | |
| SCHEMBL28085618 | 0.86 | BACE1 (0.56) | MAPTTP53POLBBACE1NPC1 | |
| SCHEMBL21880131 | 0.85 | MEN1 (0.59) | MAPTPOLBIDO1RAB9ASTAT3 | |
| SCHEMBL21880132 | 0.85 | MEN1 (0.59) | MAPTPOLBIDO1RAB9ASTAT3 | |
| SCHEMBL2312372 | 0.85 | BACE1 (0.63) | BACE1NPC1RAB9AHDAC8MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112601734-B | Oximino naphthoquinone compound and preparation method and application thereof | 普济生物科技（台州）有限公司 | 2023-05-23 | — | — | CN | disclosed |
| CN-112601734-A | Oximido naphthoquinone compound and preparation method and application thereof | 普济生物科技（台州）有限公司 | 2021-04-02 | — | — | CN | disclosed |
| WO-2020082817-A1 | NAPHTHOQUINONE OXIME COMPOUND, PREPARATION METHOD THEREFOR, AND USES THEREOF | 普济生物科技（台州）有限公司 | 2020-04-30 | — | — | WO | disclosed |
| CN-109438277-A | Oximido naphthoquinone compound and its preparation method and application | 普济生物科技（台州）有限公司 | 2019-03-08 | — | — | CN | disclosed |