Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.43 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.40 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CTSA | P10619 | 1/20 | 0.38 |
| ▸ | XDH | P47989 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.37 |
| ▸ | SCN10A | Q9Y5Y9 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | VNN1 | O95497 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL25552027 | 1.00 | PDK1 (0.43) | PDK1EGLN2ALDH1A1CYP11B1CYP11B2 | |
| SCHEMBL25552017 | 0.85 | PDK1 (0.45) | PDK1EGLN2EGLN1SCN2ASCN10A | |
| SCHEMBL30036156 | 0.85 | PDK1 (0.45) | PDK1EGLN2EGLN1SCN2ASCN10A | |
| SCHEMBL25559966 | 0.82 | NPC1 (0.48) | ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL24572726 | 0.82 | ALDH1A1 (0.61) | ALDH1A1MAPK1MEN1KMT2ALMNA | |
| SCHEMBL25560272 | 0.82 | PDK1 (0.43) | PDK1ALDH1A1CYP11B2EGLN1SCN2A | |
| SCHEMBL30037120 | 0.81 | CTSA (0.44) | EGLN2CYP11B1CYP11B2EGLN1CTSA | |
| SCHEMBL25552037 | 0.81 | CTSA (0.44) | EGLN2CYP11B1CYP11B2EGLN1CTSA | |
| SCHEMBL25551988 | 0.76 | ALDH1A1 (0.40) | ALDH1A1CYP11B1CYP11B2MAPK1CTSA | |
| SCHEMBL30036994 | 0.76 | PDK1 (0.53) | PDK1EGLN2ALDH1A1CYP11B1CYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115515940-A | Inhibitors of receptor interacting protein kinase I for the treatment of disease | 德州大学系统董事会 | 2022-12-23 | — | — | CN | disclosed |