Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.80 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.80 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.80 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.80 |
| ▸ | MAPT | P10636 | 1/20 | 0.80 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.80 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.80 |
| ▸ | GAA | P10253 | 1/20 | 0.72 |
| ▸ | NAMPT | P43490 | 3/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.66 |
| ▸ | LMNA | P02545 | 6/20 | 0.65 |
| ▸ | HTT | P42858 | 2/20 | 0.65 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.65 |
| ▸ | TSHR | P16473 | 1/20 | 0.65 |
| ▸ | CA2 | P00918 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL30679113 | 1.00 | MEN1 (0.80) | MEN1KMT2ACYP3A4CYP2D6MAPT | |
| SCHEMBL29134712 | 0.90 | GAA (0.71) | MEN1KMT2ACYP3A4CYP2D6MAPT | |
| SCHEMBL30679108 | 0.90 | GAA (0.71) | MEN1KMT2ACYP3A4CYP2D6MAPT | |
| SCHEMBL1494995 | 0.89 | GAA (0.67) | MEN1KMT2ACYP3A4CYP2D6MAPT | |
| SCHEMBL664971 | 0.83 | SMN1; SMN2 (0.71) | MEN1KMT2ACYP3A4CYP2D6MAPT | |
| SCHEMBL29635722 | 0.81 | NAMPT (1.00) | CYP2C9NAMPT | |
| SCHEMBL166113 | 0.81 | NAMPT (1.00) | CYP2C9NAMPT | |
| SCHEMBL1494812 | 0.79 | GAA (0.64) | KMT2AMAPTGAAALDH1A1LMNA | |
| SCHEMBL29134741 | 0.79 | MEN1 (0.73) | MEN1KMT2ACYP3A4CYP2D6MAPT | |
| SCHEMBL30679121 | 0.79 | MEN1 (0.73) | MEN1KMT2ACYP3A4CYP2D6MAPT |
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-117298108-A | Androgen receptor and glucocorticoid receptor dual-target inhibitor and application thereof | 浙江师范大学 | 2023-12-29 | — | — | CN | disclosed |