Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | HTT | P42858 | 3/20 | 0.54 |
| ▸ | HPGD | P15428 | 3/20 | 0.54 |
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | GLA | P06280 | 1/20 | 0.54 |
| ▸ | CASP1 | P29466 | 1/20 | 0.54 |
| ▸ | CASP7 | P55210 | 1/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ALDH1A2 | O94788 | 1/20 | 0.44 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | NQO2 | P16083 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | TNF | P01375 | 3/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL23231062 | 0.77 | BRD4 (0.43) | HTTHPGDLMNAMAPK1CYP2A6 | |
| SCHEMBL16131514 | 0.76 | HPGD (0.44) | ALDH1A1HTTHPGDGAAKDM4E | |
| SCHEMBL31364631 | 0.76 | HPGD (0.41) | ALDH1A1HTTHPGDGAAKDM4E | |
| SCHEMBL23231094 | 0.76 | HPGD (0.41) | ALDH1A1HTTHPGDKDM4ECASP1 | |
| SCHEMBL331534 | 0.76 | KEAP1 (0.44) | ALDH1A1HTTHPGDKDM4EATM | |
| SCHEMBL31364630 | 0.73 | HTT (0.43) | ALDH1A1HTTHPGDGAAKDM4E | |
| SCHEMBL9394915 | 0.72 | GAA (0.53) | ALDH1A1HPGDGAAKDM4ELMNA | |
| SCHEMBL29613191 | 0.72 | GAA (0.53) | ALDH1A1HPGDGAAKDM4ELMNA | |
| SCHEMBL31364625 | 0.72 | HPGD (0.38) | ALDH1A1HTTHPGDGAAKDM4E | |
| SCHEMBL29702360 | 0.71 | LRRK2 (0.50) | ALDH1A1HTTHPGDGAAKDM4E |
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-2021068952-A1 | BENZODIHYDROPYRAN COMPOUND TARGETING ALDO-KETO REDUCTASE 1C3 | 南京明德新药研发有限公司 | 2021-04-15 | — | — | WO | disclosed |