Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 2/20 | 0.45 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 2/20 | 0.38 |
| ▸ | KMO | O15229 | 2/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.37 |
| ▸ | NSD2 | O96028 | 1/20 | 0.37 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.37 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.37 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.37 |
| ▸ | ATR | Q13535 | 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 | |
|---|---|---|---|---|
| SCHEMBL25552017 | 1.00 | PDK1 (0.45) | PDK1SLC22A12MAP4K4EGLN1MMP2 | |
| SCHEMBL25560272 | 0.85 | PDK1 (0.43) | PDK1SLC22A12EGLN1MMP2PARP1 | |
| SCHEMBL30037043 | 0.85 | PDK1 (0.43) | PDK1EGLN1EGLN2SCN2ASCN10A | |
| SCHEMBL25552027 | 0.85 | PDK1 (0.43) | PDK1EGLN1EGLN2SCN2ASCN10A | |
| SCHEMBL25559540 | 0.83 | PPARG (0.41) | SLC22A12MAP4K4EGLN1MMP2PTGER4 | |
| SCHEMBL25252045 | 0.83 | KDM4E (0.45) | PDK1KMOGAA | |
| SCHEMBL25213116 | 0.83 | KDM1A (0.44) | SLC22A12MAP4K4EGLN1MMP2PARP1 | |
| SCHEMBL24572723 | 0.82 | NTRK1 (0.45) | KMO | |
| SCHEMBL25250193 | 0.81 | KMO (0.46) | EGLN1KMOPTGDR2 | |
| SCHEMBL32680058 | 0.81 | KMO (0.46) | EGLN1KMOPTGDR2 |
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 |