Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB1 | P05556 | 16/20 | 0.65 |
| ▸ | ITGA4 | P13612 | 16/20 | 0.65 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.60 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.58 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL3901904 | 0.84 | ITGB1 (0.59) | ITGB1ITGA4ITGB7HCRTR1HCRTR2 | |
| SCHEMBL3901901 | 0.84 | ITGB1 (0.59) | ITGB1ITGA4ITGB7HCRTR1HCRTR2 | |
| SCHEMBL3904073 | 0.83 | ITGB1 (0.67) | ITGB1ITGA4ITGB7 | |
| SCHEMBL3904078 | 0.83 | ITGB1 (0.67) | ITGB1ITGA4ITGB7 | |
| SCHEMBL30677961 | 0.83 | ITGB1 (0.65) | ITGB1ITGA4ITGB7HCRTR1HCRTR2 | |
| SCHEMBL20156010 | 0.81 | MMP2 (0.66) | — | |
| SCHEMBL6429278 | 0.79 | ITGB1 (0.60) | ITGB1ITGA4ITGB7HCRTR1HCRTR2 | |
| SCHEMBL7971208 | 0.79 | ITGB1 (1.00) | ITGB1ITGA4ITGB7HCRTR1HCRTR2 | |
| SCHEMBL7957794 | 0.79 | ITGB1 (0.96) | ITGB1ITGA4ITGB7HCRTR1HCRTR2 | |
| SCHEMBL7352118 | 0.79 | ITGB1 (1.00) | ITGB1ITGA4ITGB7HCRTR1HCRTR2 |
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-113549065-B | Pyrrolo [2,3-b ] pyridine derivatives as JAK inhibitors | 成都先导药物开发股份有限公司 | 2022-05-10 | — | — | CN | disclosed |