Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGAV | P06756 | 10/20 | 0.44 |
| ▸ | ITGB3 | P05106 | 9/20 | 0.44 |
| ▸ | NNMT | P40261 | 1/20 | 0.39 |
| ▸ | UHRF1 | Q96T88 | 1/20 | 0.38 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.31 |
| ▸ | ITGB6 | P18564 | 1/20 | 0.30 |
| ▸ | ITGB8 | P26012 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL26015977 | 0.95 | ITGB3 (0.41) | ITGAVITGB3NNMTUHRF1CXCR4 | |
| SCHEMBL13355389 | 0.79 | UHRF1 (0.43) | ITGAVITGB3NNMTUHRF1MAPT | |
| SCHEMBL30935211 | 0.75 | NNMT (0.41) | ITGAVITGB3NNMTUHRF1MAPT | |
| SCHEMBL26013992 | 0.75 | NNMT (0.38) | ITGAVITGB3NNMTUHRF1MAPT | |
| SCHEMBL25468393 | 0.74 | UHRF1 (0.39) | ITGAVITGB3NNMTUHRF1MAPT | |
| SCHEMBL14726025 | 0.73 | CDK5 (0.44) | — | |
| SCHEMBL22016869 | 0.73 | CDK5 (0.41) | — | |
| SCHEMBL279379 | 0.72 | CXCR4 (0.42) | ITGAVITGB3UHRF1CXCR4ITGA2B | |
| SCHEMBL24198298 | 0.71 | CDK5 (0.43) | — | |
| SCHEMBL25060990 | 0.71 | CDK5 (0.43) | — |
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-2022007966-A1 | PB2 INHIBITOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 四川海思科制药有限公司 | 2022-01-13 | — | — | WO | disclosed |