Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.32 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | TYR | P14679 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL26091036 | 1.00 | KDM4E (0.33) | KDM4EHTTNPSR1ALDH1A1GAA | |
| SCHEMBL26091306 | 0.80 | GAA (0.32) | HTTNPSR1ALDH1A1GAAALOX12 | |
| SCHEMBL26450782 | 0.78 | NR1H2 (0.43) | HTTNPSR1ALDH1A1GAAALOX12 | |
| SCHEMBL26118833 | 0.70 | — | — | |
| SCHEMBL26118839 | 0.70 | — | — | |
| SCHEMBL17666921 | 0.69 | CTSK (0.46) | KDM4EHTTNPSR1ALDH1A1GAA | |
| SCHEMBL26090195 | 0.69 | KDM4E (0.38) | KDM4EHTTNPSR1ALDH1A1GAA | |
| SCHEMBL5722019 | 0.67 | EPHX1 (0.44) | KDM4EHTTALDH1A1L3MBTL1 | |
| SCHEMBL321958 | 0.67 | — | — | |
| SCHEMBL27863623 | 0.65 | — | — |
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-2023067515-A1 | THIADIAZOLYL COMPOUNDS AS DNA POLYMERASE THETA INHIBITORS | IDEAYA BIOSCIENCES, INC. (US) | 2023-04-27 | — | — | WO | disclosed |