Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 2/20 | 0.53 |
| ▸ | PPARA | Q07869 | 3/20 | 0.50 |
| ▸ | PPARG | P37231 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CTSK | P43235 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.41 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | NR1D1 | P20393 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.40 |
| ▸ | LDHA | P00338 | 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 | |
|---|---|---|---|---|
| SCHEMBL12203612 | 0.80 | ACACB (0.58) | CACNA1BPPARAPPARGALDH1A1LMNA | |
| SCHEMBL8732751 | 0.80 | ACACB (0.58) | CACNA1BPPARAPPARGALDH1A1LMNA | |
| SCHEMBL21043375 | 0.77 | CA1 (0.52) | CACNA1BPPARAPPARGALDH1A1LMNA | |
| SCHEMBL10276786 | 0.76 | CA2 (0.55) | ALDH1A1LMNACTSKCA2 | |
| SCHEMBL10276787 | 0.76 | CA2 (0.55) | ALDH1A1LMNACTSKCA2 | |
| SCHEMBL20397698 | 0.76 | PPARG (0.52) | CACNA1BPPARAPPARGALDH1A1LMNA | |
| SCHEMBL14813554 | 0.75 | CACNA1B (0.47) | CACNA1BPPARAPPARGALDH1A1LMNA | |
| SCHEMBL14813555 | 0.75 | CACNA1B (0.47) | CACNA1BPPARAPPARGALDH1A1LMNA | |
| SCHEMBL21260591 | 0.75 | PPARG (0.60) | CACNA1BPPARAPPARGALDH1A1LMNA | |
| SCHEMBL20661670 | 0.75 | ATM (0.53) | CACNA1BPPARAPPARGALDH1A1LMNA |
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-2023098857-A1 | IRAK4 INHIBITOR AND USE THEREOF | 武汉人福创新药物研发中心有限公司 | 2023-06-08 | — | — | WO | disclosed |