Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.67 |
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | CDC25B | P30305 | 1/20 | 0.42 |
| ▸ | APAF1 | O14727 | 2/20 | 0.41 |
| ▸ | TDP2 | O95551 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | BCHE | P06276 | 2/20 | 0.41 |
| ▸ | CES1 | P23141 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | S100A4 | P26447 | 2/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | TERT | O14746 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2281241 | 0.80 | ALDH1A1 (1.00) | ALDH1A1CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL30042976 | 0.80 | ALDH1A1 (1.00) | ALDH1A1CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL2281246 | 0.80 | ALDH1A1 (1.00) | ALDH1A1CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL7885392 | 0.80 | ALDH1A1 (1.00) | ALDH1A1CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL27597926 | 0.77 | ALDH1A1 (0.41) | ALDH1A1CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL1670775 | 0.73 | CES1 (0.62) | ALDH1A1CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL11316178 | 0.73 | ALDH1A1 (0.79) | ALDH1A1CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL11316175 | 0.73 | ALDH1A1 (0.79) | ALDH1A1CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL2987590 | 0.72 | CDC25B (0.48) | ALDH1A1CYP1A2CYP2C19MEN1KMT2A | |
| SCHEMBL88188 | 0.72 | CES1 (0.52) | ALDH1A1CYP1A2MEN1KMT2ACDC25B |
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-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-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 |