Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGAV | P06756 | 9/20 | 0.33 |
| ▸ | ITGB3 | P05106 | 5/20 | 0.33 |
| ▸ | ITGB5 | P18084 | 3/20 | 0.33 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.33 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.33 |
| ▸ | ITGB6 | P18564 | 4/20 | 0.32 |
| ▸ | CCR5 | P51681 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28692098 | 0.89 | CCR5 (0.36) | ITGAVITGB6CCR5 | |
| Trifluoroacetic Acid SCHEMBL29393315 | 0.80 | ITGAV (0.47) | ITGAVITGB3ITGB5ITGB1ITGA5 | |
| SCHEMBL28708231 | 0.79 | ITGB3 (0.37) | ITGAVITGB3ITGB5ITGB1 | |
| SCHEMBL28699748 | 0.79 | ITGAV (0.35) | ITGAVITGB3ITGB5ITGB1ITGA5 | |
| SCHEMBL29369724 | 0.79 | LMNA (0.40) | ITGAVITGB3ITGB5ITGB1ITGA5 | |
| SCHEMBL28696946 | 0.79 | CCR5 (0.39) | ITGAVITGB3ITGB5ITGB6CCR5 | |
| SCHEMBL29369797 | 0.77 | HRH3 (0.35) | ITGAVITGB3ITGB5ITGB1ITGA5 | |
| SCHEMBL29369631 | 0.77 | ITGB3 (0.43) | ITGAVITGB3 | |
| SCHEMBL29370168 | 0.75 | ITGAV (0.53) | ITGAVITGB3ITGB5ITGB1ITGB6 | |
| SCHEMBL28337910 | 0.70 | ITGAV (0.40) | ITGAVITGB3ITGB5ITGB6 |
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-2022022364-A1 | PYRROLIDINE INTEGRIN MODULATOR AND USE THEREOF | 清药同创(北京)药物研发中心有限公司 | 2022-02-03 | — | — | WO | disclosed |