Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.47 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3282634 | 1.00 | TP53 (0.55) | TP53TSHRSMN1; SMN2ALDH1A1MAPK1 | |
| SCHEMBL25939514 | 1.00 | TP53 (0.55) | TP53TSHRSMN1; SMN2ALDH1A1MAPK1 | |
| SCHEMBL9949812 | 0.89 | TSHR (0.64) | TSHRALDH1A1MAPK1MAPTAKR1C3 | |
| SCHEMBL9949602 | 0.89 | TSHR (0.64) | TSHRALDH1A1MAPK1MAPTAKR1C3 | |
| SCHEMBL1439777 | 0.89 | TSHR (0.64) | TSHRALDH1A1MAPK1MAPTAKR1C3 | |
| SCHEMBL607186 | 0.88 | TP53 (0.63) | TP53TSHRSMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL28155393 | 0.86 | TP53 (0.56) | TP53TSHRSMN1; SMN2ALDH1A1MAPK1 | |
| SCHEMBL16887552 | 0.84 | TP53 (0.55) | TP53TSHRSMN1; SMN2ALDH1A1MAPK1 | |
| SCHEMBL16892253 | 0.84 | TP53 (0.55) | TP53TSHRSMN1; SMN2ALDH1A1MAPK1 | |
| SCHEMBL16892258 | 0.84 | TP53 (0.55) | TP53TSHRSMN1; SMN2ALDH1A1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023141852-A1 | CDK2 INHIBITORS, PREPARATION METHOD THEREFOR AND USE THEREOF | 益方生物科技(上海)股份有限公司 | 2023-08-03 | — | — | WO | disclosed |