Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | ACACB | O00763 | 1/20 | 0.37 |
| ▸ | ACACA | Q13085 | 1/20 | 0.37 |
| ▸ | HMGCR | P04035 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | GGT1 | P19440 | 1/20 | 0.30 |
| ▸ | PPARA | Q07869 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23217911 | 1.00 | ACLY (0.48) | ACLYTSHRALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL18704292 | 0.88 | ACLY (0.41) | ACLYTSHRALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL18704294 | 0.88 | ACLY (0.41) | ACLYTSHRALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL132112 | 0.87 | ACLY (0.43) | ACLYTSHRALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL132109 | 0.87 | ACLY (0.43) | ACLYTSHRALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL20533115 | 0.87 | ACLY (0.43) | ACLYTSHRALDH1A1CYP2D6CYP2C19 | |
| SCHEMBL10584864 | 0.86 | ACLY (0.48) | ACLYCYP2C19CHRM1TBXA2RALOX15 | |
| SCHEMBL10584851 | 0.86 | ACLY (0.48) | ACLYCYP2C19CHRM1TBXA2RALOX15 | |
| SCHEMBL2882121 | 0.84 | ALDH1A1 (0.48) | ACLYALDH1A1ALOX15KDM4EL3MBTL1 | |
| SCHEMBL91183 | 0.84 | ACLY (0.38) | ACLYACACBACACA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114945573-A | Prodrugs of myeloperoxidase inhibitors | 拜奥海芬治疗学有限公司 | 2022-08-26 | — | — | CN | disclosed |
| WO-2021072140-A1 | PRODRUGS OF MYELOPEROXIDASE INHIBITORS | BIOHAVEN THERAPEUTICS LTD. (US) | 2021-04-15 | — | — | WO | disclosed |