Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGAV | P06756 | 12/20 | 0.37 |
| ▸ | ITGB6 | P18564 | 10/20 | 0.37 |
| ▸ | FGFR4 | P22455 | 3/20 | 0.35 |
| ▸ | HRH2 | P25021 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.35 |
| ▸ | DRD4 | P21917 | 2/20 | 0.33 |
| ▸ | LTA4H | P09960 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 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 | |
|---|---|---|---|---|
| SCHEMBL28690096 | 1.00 | ITGAV (0.37) | ITGAVITGB6FGFR4HRH2HRH1 | |
| SCHEMBL30474568 | 0.88 | ITGAV (0.37) | ITGAVITGB6HRH2HRH1HRH3 | |
| SCHEMBL28708230 | 0.82 | ITGAV (0.40) | ITGAVITGB6ITGB3DRD4LTA4H | |
| SCHEMBL28708228 | 0.82 | ITGAV (0.40) | ITGAVITGB6ITGB3DRD4LTA4H | |
| SCHEMBL28699748 | 0.80 | ITGAV (0.35) | ITGAVITGB6ITGB3 | |
| SCHEMBL28501228 | 0.78 | GRIN2B (0.38) | ITGAVITGB6FGFR4ITGB3DRD4 | |
| SCHEMBL28337154 | 0.78 | ITGAV (0.36) | ITGAVITGB6FGFR4ITGB3 | |
| SCHEMBL29369797 | 0.77 | HRH3 (0.35) | ITGAVITGB6FGFR4HRH3ITGB3 | |
| SCHEMBL21328960 | 0.76 | ITGAV (0.37) | ITGAVITGB6FGFR4ITGB3 | |
| SCHEMBL28879393 | 0.76 | KCNA3 (0.35) | ITGAVHRH1HRH3ITGB3 |
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-113354635-A | Pyrrolidine integrin regulator and application thereof | 清药同创(北京)药物研发中心有限公司 | 2021-09-07 | — | — | CN | disclosed |