Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.44 |
| ▸ | AGXT | P21549 | 2/20 | 0.44 |
| ▸ | MMP2 | P08253 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 3/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MMP9 | P14780 | 1/20 | 0.39 |
| ▸ | MMP12 | P39900 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22717962 | 0.82 | IDO1 (0.41) | MEN1KMT2AMAPTIDO1ALDH1A1 | |
| SCHEMBL22732123 | 0.81 | IDO1 (0.44) | MEN1KMT2AMAPTIDO1AGXT | |
| SCHEMBL29694804 | 0.81 | SLC6A4 (0.40) | MEN1KMT2AMAPTIDO1MAOA | |
| SCHEMBL1267690 | 0.81 | CA12 (0.55) | MEN1KMT2AMAPTIDO1POLB | |
| SCHEMBL29574285 | 0.78 | RAB9A (0.45) | MEN1KMT2AMAPTPOLBL3MBTL1 | |
| SCHEMBL22717358 | 0.78 | RAB9A (0.45) | MEN1KMT2AMAPTPOLBL3MBTL1 | |
| SCHEMBL11231967 | 0.76 | IDO1 (0.50) | MEN1KMT2AMAPTNPSR1IDO1 | |
| SCHEMBL11626500 | 0.76 | IDO1 (0.50) | MEN1KMT2AMAPTNPSR1IDO1 | |
| SCHEMBL22732129 | 0.75 | RAB9A (0.36) | KMT2AMAPTNPSR1L3MBTL1ALDH1A1 | |
| SCHEMBL6689599 | 0.75 | IDO1 (0.54) | MEN1KMT2AMAPTNPSR1IDO1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3976608-B1 | THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS | IDEAYA BIOSCIENCES INC (US) | 2023-11-08 | — | — | EP | disclosed |
| CN-114127062-A | Thiadiazolyl derivatives as inhibitors of DNA polymerase Theta | 伊迪亚生物科学有限公司 | 2022-03-01 | — | — | CN | disclosed |
| WO-2020243459-A1 | THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS | IDEAYA BIOSCIENCES, INC. (US) | 2020-12-03 | — | — | WO | disclosed |