Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 1/20 | 0.39 |
| ▸ | PIM1 | P11309 | 6/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.36 |
| ▸ | GSK3B | P49841 | 3/20 | 0.36 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.36 |
| ▸ | FLT3 | P36888 | 2/20 | 0.36 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | PIM2 | Q9P1W9 | 5/20 | 0.35 |
| ▸ | PIM3 | Q86V86 | 2/20 | 0.35 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.35 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | MKNK2 | Q9HBH9 | 4/20 | 0.33 |
| ▸ | MKNK1 | Q9BUB5 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | F9 | P00740 | 1/20 | 0.32 |
| ▸ | NTRK2 | Q16620 | 2/20 | 0.32 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.32 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24823391 | 0.86 | CYP17A1 (0.38) | CYP17A1PIM1CLK4GSK3BNTRK1 | |
| SCHEMBL30310922 | 0.86 | CYP17A1 (0.38) | CYP17A1PIM1CLK4GSK3BNTRK1 | |
| SCHEMBL29871724 | 0.68 | CLK4 (0.49) | CYP17A1PIM1CLK4GSK3BNTRK1 | |
| SCHEMBL10139776 | 0.68 | HTT (0.52) | PIM1CLK4GSK3BNTRK1FLT3 | |
| SCHEMBL31195434 | 0.68 | HTT (0.52) | PIM1CLK4GSK3BNTRK1FLT3 | |
| SCHEMBL5230177 | 0.67 | PARP1 (0.46) | PIM1CLK4GSK3BNTRK1FLT3 | |
| SCHEMBL29010946 | 0.67 | NTRK2 (0.35) | CYP17A1CLK4GSK3BNTRK1FLT3 | |
| SCHEMBL29010943 | 0.66 | KDM4E (0.38) | MAPK1 | |
| SCHEMBL30310966 | 0.66 | KDM4E (0.38) | MAPK1 | |
| SCHEMBL31741758 | 0.66 | MKNK2 (0.51) | CYP17A1CLK4GSK3BNTRK1FLT3 |
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-2022267930-A1 | TRICYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF | 中国医药研究开发中心有限公司 | 2022-12-29 | — | — | WO | disclosed |