Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.45 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 15/20 | 0.44 |
| ▸ | CA1 | P00915 | 14/20 | 0.44 |
| ▸ | CA9 | Q16790 | 10/20 | 0.43 |
| ▸ | CA12 | O43570 | 8/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14621353 | 0.83 | NMT1 (0.43) | ITGB3ITGA2B | |
| SCHEMBL3389631 | 0.78 | ALDH1A1 (0.52) | ITGB3ITGA2BMAPT | |
| SCHEMBL14621446 | 0.78 | KHK (0.41) | ITGB3ITGA2B | |
| SCHEMBL23657189 | 0.76 | CA1 (0.63) | CA2CA1CA9CA12 | |
| SCHEMBL17315368 | 0.73 | CA1 (0.68) | CA2CA1CA9CA12 | |
| SCHEMBL27917814 | 0.72 | GBA1 (0.56) | CA2CA1CA9CA12MAPT | |
| SCHEMBL14621354 | 0.72 | ITGB3 (0.40) | ITGB3ITGA2B | |
| SCHEMBL18361697 | 0.71 | CA2 (0.49) | CA2CA1CA9CA12 | |
| SCHEMBL25031242 | 0.71 | CA2 (0.68) | CA2CA1CA9CA12MAPT | |
| SCHEMBL28736087 | 0.71 | CA2 (0.54) | CA2CA1CA9CA12 |
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-2021145729-A1 | NOVEL COMPOUND, PREPARATION METHOD THEREOF, AND USE THEREOF | DAEGU-GYEONGBUK MEDICAL INNOVATION FOUNDATION (KR) | 2021-07-22 | — | — | WO | disclosed |