Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.34 |
| ▸ | FGFR2 | P21802 | 1/20 | 0.34 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 3/20 | 0.33 |
| ▸ | GSK3A | P49840 | 2/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.33 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.33 |
| ▸ | SGK1 | O00141 | 9/20 | 0.33 |
| ▸ | JAK2 | O60674 | 2/20 | 0.32 |
| ▸ | JAK1 | P23458 | 2/20 | 0.32 |
| ▸ | TYK2 | P29597 | 2/20 | 0.32 |
| ▸ | JAK3 | P52333 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20699358 | 1.00 | ESR1 (0.36) | ESR1ESR2FGFR1FGFR2FGFR3 | |
| Trifluoroacetic Acid SCHEMBL29607409 | 0.92 | ESR1 (0.34) | ESR1ESR2GSK3BGSK3ACDK2 | |
| SCHEMBL30161563 | 0.83 | IDO1 (0.38) | GSK3BGSK3ACDK2PIK3CAPIK3CD | |
| SCHEMBL20699371 | 0.83 | IDO1 (0.38) | GSK3BGSK3ACDK2PIK3CAPIK3CD | |
| SCHEMBL20715202 | 0.82 | ESR1 (0.34) | ESR1ESR2GSK3BGSK3AALK | |
| SCHEMBL20699365 | 0.82 | JAK3 (0.39) | JAK3 | |
| SCHEMBL20711756 | 0.80 | SGK1 (0.33) | ESR1ESR2GSK3BGSK3ACDK2 | |
| SCHEMBL20699342 | 0.78 | SGK1 (0.41) | ESR1ESR2FGFR1FGFR2FGFR3 | |
| SCHEMBL30161715 | 0.78 | SGK1 (0.41) | ESR1ESR2FGFR1FGFR2FGFR3 | |
| SCHEMBL17667703 | 0.76 | GSK3B (0.37) | ESR1ESR2FGFR1FGFR2FGFR3 |
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-111032646-B | Pyrazolo and triazolo bicyclic compounds as JAK kinase inhibitors | 施万生物制药研发IP有限责任公司 | 2023-01-03 | — | — | CN | disclosed |