Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.59 |
| ▸ | HPGD | P15428 | 2/20 | 0.59 |
| ▸ | CA2 | P00918 | 3/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | CA1 | P00915 | 1/20 | 0.56 |
| ▸ | RARB | P10826 | 1/20 | 0.53 |
| ▸ | PLK1 | P53350 | 1/20 | 0.53 |
| ▸ | ESR1 | P03372 | 2/20 | 0.52 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.52 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.52 |
| ▸ | TACR2 | P21452 | 2/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | SHBG | P04278 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL83869 | 0.89 | CA2 (0.65) | ALDH1A1HSD17B10HPGDCA2SMN1; SMN2 | |
| SCHEMBL9839955 | 0.86 | CA2 (0.62) | ALDH1A1HSD17B10HPGDCA2SMN1; SMN2 | |
| SCHEMBL10568421 | 0.86 | ALDH1A1 (0.65) | ALDH1A1HSD17B10HPGDCA2SMN1; SMN2 | |
| Ammonia Solution, Strong SCHEMBL28990998 | 0.86 | CA2 (0.62) | ALDH1A1HSD17B10HPGDCA2SMN1; SMN2 | |
| SCHEMBL10567971 | 0.83 | ALDH1A1 (0.70) | ALDH1A1HSD17B10HPGDCA2SMN1; SMN2 | |
| SCHEMBL6680875 | 0.83 | CA2 (0.60) | ALDH1A1HSD17B10HPGDCA2SMN1; SMN2 | |
| SCHEMBL6682508 | 0.83 | ALDH1A1 (0.70) | ALDH1A1HSD17B10HPGDCA2SMN1; SMN2 | |
| SCHEMBL3031496 | 0.82 | ALDH1A1 (0.57) | ALDH1A1HSD17B10HPGDCA2SMN1; SMN2 | |
| SCHEMBL346425 | 0.82 | ALDH1A1 (0.57) | ALDH1A1HSD17B10HPGDCA2SMN1; SMN2 | |
| SCHEMBL10012224 | 0.82 | CA2 (0.54) | ALDH1A1HSD17B10HPGDCA2SMN1; SMN2 |
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-2020116646-A1 | ORGANIC-INORGANIC COMPOSITE MATERIAL | 帝人株式会社 | 2020-06-11 | — | — | WO | disclosed |