Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRC | P12931 | 6/20 | 0.35 |
| ▸ | ABL1 | P00519 | 5/20 | 0.35 |
| ▸ | NT5E | P21589 | 13/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL22281977 | 0.75 | NT5E (0.50) | NT5E | |
| SCHEMBL22282190 | 0.75 | NT5E (0.49) | NT5E | |
| SCHEMBL28608852 | 0.73 | NT5E (0.59) | NT5E | |
| SCHEMBL22282185 | 0.70 | NT5E (0.39) | NT5E | |
| SCHEMBL28610588 | 0.69 | SRC (0.39) | SRCABL1NT5EADORA1ALDH1A1 | |
| SCHEMBL22281996 | 0.68 | NT5E (0.37) | NT5E | |
| SCHEMBL22281833 | 0.68 | NT5E (0.40) | SRCABL1NT5E | |
| SCHEMBL22281986 | 0.68 | NT5E (0.40) | SRCABL1NT5E | |
| SCHEMBL22281819 | 0.67 | — | — | |
| SCHEMBL22282192 | 0.67 | SRC (0.36) | SRCABL1NT5EADORA1ALDH1A1 |
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-2020151707-A1 | NOVEL SMALL MOLECULE CD73 INHIBITOR, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF | 江苏恒瑞医药股份有限公司 | 2020-07-30 | — | — | WO | disclosed |