Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | RAD52 | P43351 | 1/20 | 0.37 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.36 |
| ▸ | HSD17B2 | P37059 | 2/20 | 0.36 |
| ▸ | STS | P08842 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27393718 | 0.78 | CYP2C9 (0.44) | CYP2C9ALDH1A1HPGDHSD17B1HSD17B2 | |
| SCHEMBL11135619 | 0.76 | CA12 (0.42) | CYP2C9CA1CA2CA12CA7 | |
| SCHEMBL14662766 | 0.72 | POLB (0.42) | CYP2C9CA1CA2ALDH1A1HPGD | |
| SCHEMBL19456045 | 0.71 | SIGMAR1 (0.56) | ALDH1A1HSD17B1HSD17B2 | |
| SCHEMBL11310244 | 0.68 | CRHR1 (0.42) | CA1CA2CA12CA7CA9 | |
| SCHEMBL24497695 | 0.68 | CYP2C9 (0.50) | CYP2C9ALDH1A1KDM4ESMN1; SMN2KMT2A | |
| SCHEMBL13362708 | 0.66 | HTT (0.44) | CYP2C9CA1CA2CA12CA7 | |
| SCHEMBL27341362 | 0.66 | ALDH1A1 (0.43) | CYP2C9CA1CA2CA12CA7 | |
| SCHEMBL5437925 | 0.66 | HTR3E (0.41) | CA1CA2CA12CA7CA9 | |
| SCHEMBL11307533 | 0.66 | CRHR1 (0.46) | ALDH1A1 |
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-2023274251-A1 | POLYCYCLIC COMPOUND FOR INHIBITING RNA HELICASE DHX33, AND APPLICATION OF COMPOUND | 深圳开悦生命科技有限公司 | 2023-01-05 | — | — | WO | disclosed |