Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 1/20 | 0.44 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.44 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.42 |
| ▸ | TOP2A | P11388 | 1/20 | 0.40 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.39 |
| ▸ | KCNQ4 | P56696 | 2/20 | 0.39 |
| ▸ | KCNQ5 | Q9NR82 | 2/20 | 0.39 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.38 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.38 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL6627242 | 0.89 | CYP17A1 (0.47) | CYP17A1TOP2ATOP2BLCKPDK1 | |
| SCHEMBL15858093 | 0.89 | CYP17A1 (0.47) | CYP17A1TOP2ATOP2BLCKPDK1 | |
| SCHEMBL28860305 | 0.86 | CA12 (0.43) | CYP17A1KCNQ4KCNQ5CA12CA1 | |
| SCHEMBL4752155 | 0.84 | TOP2A (0.46) | CYP17A1TOP2ATOP2BLCKPDK1 | |
| SCHEMBL18411746 | 0.84 | CYP17A1 (0.43) | CYP17A1TOP2ATOP2BLCKPDK1 | |
| SCHEMBL6296543 | 0.84 | CYP17A1 (0.43) | CYP17A1TOP2ATOP2BLCKMAPK14 | |
| SCHEMBL30301016 | 0.83 | CTSS (0.44) | CYP17A1TOP2ATOP2BKCNQ4KCNQ5 | |
| SCHEMBL25808870 | 0.83 | CTSS (0.44) | CYP17A1TOP2ATOP2BKCNQ4KCNQ5 | |
| SCHEMBL13623134 | 0.82 | CYP17A1 (0.42) | CYP17A1TOP2ATOP2BLCKMAPK14 | |
| SCHEMBL89282 | 0.81 | KMT2A (0.45) | CYP17A1TOP2ATOP2BLCKMAPK14 |
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-2023109954-A1 | TYK2 INHIBITORS AND COMPOSITIONS AND METHODS THEREOF | LYNK PHARMACEUTICALS CO. LTD. (CN) | 2023-06-22 | — | — | WO | disclosed |