Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VNN1 | O95497 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.34 |
| ▸ | FEN1 | P39748 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.32 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.32 |
| ▸ | PIK3R2 | O00459 | 1/20 | 0.32 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.32 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.32 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.32 |
| ▸ | PIK3R5 | Q8WYR1 | 1/20 | 0.32 |
| ▸ | PIK3R3 | Q92569 | 1/20 | 0.32 |
| ▸ | PDCD1 | Q15116 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28582531 | 1.00 | VNN1 (0.35) | VNN1CA12CA1CA2CA9 | |
| SCHEMBL28582530 | 1.00 | VNN1 (0.35) | VNN1CA12CA1CA2CA9 | |
| SCHEMBL23408498 | 0.88 | CNR2 (0.38) | VNN1CA12CA1CA2CA9 | |
| SCHEMBL29968500 | 0.86 | CA12 (0.35) | VNN1CA12CA1CA2CA9 | |
| SCHEMBL23408450 | 0.77 | PIK3CD (0.35) | VNN1CA12CA1CA2CA9 | |
| SCHEMBL28569870 | 0.72 | ATR (0.34) | VNN1ALOX5APFEN1PRMT5 | |
| SCHEMBL23629194 | 0.72 | ATR (0.34) | VNN1ALOX5APFEN1PRMT5 | |
| SCHEMBL24024047 | 0.71 | VNN1 (0.30) | VNN1 | |
| SCHEMBL23629188 | 0.70 | VNN1 (0.35) | VNN1CA12CA1CA2CA9 | |
| SCHEMBL28560469 | 0.70 | VNN1 (0.35) | VNN1CA12CA1CA2CA9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4063363-A1 | PYRAZOLO-HETEROARYL DERIVATIVE, PREPARATION METHOD THEREFOR, AND MEDICAL USE THEREOF | Jiangsu Hengrui Pharmaceuticals Co., Ltd. (CN) | 2022-09-28 | — | — | EP | disclosed |