Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 5/20 | 0.53 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.36 |
| ▸ | S100A4 | P26447 | 1/20 | 0.35 |
| ▸ | PTPRC | P08575 | 1/20 | 0.35 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | BCL2 | P10415 | 1/20 | 0.34 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | TDP2 | O95551 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24517455 | 1.00 | PDK2 (0.53) | PDK2OPRM1OPRD1CA1CA2 | |
| SCHEMBL29618362 | 1.00 | PDK2 (0.53) | PDK2OPRM1OPRD1CA1CA2 | |
| SCHEMBL28758440 | 0.89 | PDK2 (0.46) | PDK2OPRM1OPRD1CA1CA2 | |
| SCHEMBL31202620 | 0.80 | PDK2 (0.53) | PDK2AKR1C1HSP90AA1ALDH1A1MAPT | |
| SCHEMBL10554281 | 0.80 | PDK2 (0.53) | PDK2AKR1C1HSP90AA1ALDH1A1MAPT | |
| SCHEMBL31073015 | 0.76 | OPRM1 (0.47) | PDK2OPRM1OPRD1CA1CA2 | |
| SCHEMBL23526283 | 0.75 | PDK2 (0.42) | PDK2OPRM1OPRD1CA1CA2 | |
| SCHEMBL16064982 | 0.71 | OPRM1 (0.46) | PDK2OPRM1OPRD1CA1CA2 | |
| SCHEMBL29922211 | 0.71 | OPRM1 (0.46) | PDK2OPRM1OPRD1CA1CA2 | |
| SCHEMBL12460624 | 0.69 | PDK2 (1.00) | PDK2 |
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-114591293-A | Fused ring compound as Nav1.8 inhibitor and application thereof | 成都康弘药业集团股份有限公司 | 2022-06-07 | — | — | CN | disclosed |