Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 2/20 | 0.42 |
| ▸ | GPR35 | Q9HC97 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ASPH | Q12797 | 1/20 | 0.41 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.41 |
| ▸ | XDH | P47989 | 1/20 | 0.41 |
| ▸ | PPARD | Q03181 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | EIF4E | P06730 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | BRS3 | P32247 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CLCN2 | P51788 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22717565 | 1.00 | DHODH (0.42) | DHODHGPR35KDM4EASPHKDM8 | |
| SCHEMBL22731928 | 0.90 | CDC7 (0.43) | NPC1THRBRAB9AALDH1A1HPGD | |
| SCHEMBL22717528 | 0.89 | VDR (0.43) | KDM4EPPARDNPC1THRBRAB9A | |
| SCHEMBL22717450 | 0.82 | GPR35 (0.46) | DHODHGPR35KDM4EXDHPPARD | |
| SCHEMBL29574343 | 0.82 | GPR35 (0.46) | DHODHGPR35KDM4EXDHPPARD | |
| SCHEMBL29574134 | 0.80 | DHODH (0.42) | DHODHGPR35KDM4EASPHKDM8 | |
| SCHEMBL22717931 | 0.80 | DHODH (0.42) | DHODHGPR35KDM4EASPHKDM8 | |
| SCHEMBL29574466 | 0.78 | DHODH (0.46) | DHODHGPR35KDM4EASPHKDM8 | |
| SCHEMBL22717518 | 0.78 | DHODH (0.46) | DHODHGPR35KDM4EASPHKDM8 | |
| SCHEMBL30526831 | 0.77 | CTSA (0.41) | — |
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 |