Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 5/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.33 |
| ▸ | BUB1 | O43683 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CTSK | P43235 | 1/20 | 0.33 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL26022904 | 0.84 | GRM5 (0.38) | GRM5USP2SMN1; SMN2ESR2GRIN2B | |
| SCHEMBL22820869 | 0.82 | GRM5 (0.33) | GRM5USP2SMN1; SMN2ESR2GRIN2B | |
| SCHEMBL22613608 | 0.79 | USP2 (0.39) | USP2SMN1; SMN2ESR2GRIN2BGRIN2C | |
| SCHEMBL29915467 | 0.78 | GRM5 (0.47) | GRM5USP2SMN1; SMN2NR1H2DDB1 | |
| SCHEMBL25699687 | 0.75 | USP2 (0.36) | USP2SMN1; SMN2ESR2GRIN2BGRIN2C | |
| SCHEMBL29915378 | 0.73 | GRM5 (0.76) | GRM5 | |
| SCHEMBL20616714 | 0.73 | GRM5 (0.76) | GRM5 | |
| SCHEMBL25306382 | 0.73 | GRIN2B (0.41) | USP2SMN1; SMN2ESR2GRIN2BGRIN2C | |
| SCHEMBL24695638 | 0.72 | GRIN2B (0.38) | USP2SMN1; SMN2ESR2GRIN2BGRIN2C | |
| SCHEMBL6245369 | 0.71 | ESR2 (0.44) | ESR2NR1H2ALDH1A1NR1H3 |
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-2023154282-A1 | COMPOUNDS HAVING A T-STRUCTURE FORMED BY AT LEAST FOUR CYCLES FOR USE IN THE TREATMENT OF CANCER AND OTHER INDICATIONS | THERAS, INC. (US) | 2023-08-17 | — | — | WO | disclosed |