Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | VDR | P11473 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.47 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL22717355 | 1.00 | KMT2A (0.50) | KMT2AALDH1A1TDP1VDRMEN1 | |
| SCHEMBL6939299 | 0.88 | RAB9A (0.48) | KMT2AALDH1A1TDP1MEN1RAB9A | |
| SCHEMBL10027994 | 0.87 | KDM4E (0.59) | KMT2AALDH1A1TDP1MEN1RAB9A | |
| SCHEMBL2199058 | 0.86 | TSHR (0.51) | KMT2AALDH1A1MEN1TP53MAPT | |
| SCHEMBL29574629 | 0.85 | PARP1 (0.51) | KMT2AALDH1A1MEN1RAB9AGAA | |
| SCHEMBL6175665 | 0.85 | PARP1 (0.51) | KMT2AALDH1A1MEN1RAB9AGAA | |
| SCHEMBL2201598 | 0.83 | MEN1 (0.45) | KMT2AALDH1A1MEN1RAB9AGAA | |
| SCHEMBL29574044 | 0.82 | SLC6A4 (0.50) | KMT2AALDH1A1TDP1MEN1GAA | |
| SCHEMBL16547421 | 0.82 | TDP1 (0.50) | KMT2AALDH1A1TDP1MEN1SMN1; SMN2 | |
| SCHEMBL22717702 | 0.82 | SLC6A4 (0.50) | KMT2AALDH1A1TDP1MEN1GAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3976608-A1 | THIADIAZOLYL DERIVATIVES AS DNA POLYMERASE THETA INHIBITORS | Ideaya Biosciences, Inc. (US) | 2022-04-06 | — | — | EP | disclosed |