Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | CCR6 | P51684 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | HCAR1 | Q9BXC0 | 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 | |
|---|---|---|---|---|
| SCHEMBL11401376 | 0.75 | — | — | |
| SCHEMBL12354590 | 0.67 | BPTF (0.33) | — | |
| SCHEMBL28030094 | 0.62 | ADRB1 (0.39) | NPSR1MAPTALDH1A1HSP90AA1CCR6 | |
| SCHEMBL24197603 | 0.60 | ALDH1A1 (0.40) | ALDH1A1 | |
| SCHEMBL28300826 | 0.59 | ALDH1A1 (0.50) | NPSR1MAPTALDH1A1HSP90AA1CCR6 | |
| SCHEMBL341533 | 0.58 | ALDH1A1 (0.67) | ALDH1A1HSP90AA1CCR6 | |
| SCHEMBL26115 | 0.58 | — | — | |
| SCHEMBL1138607 | 0.57 | ADRB1 (0.66) | MAPTALDH1A1 | |
| SCHEMBL4760153 | 0.56 | ALDH1A1 (0.40) | NPSR1MAPTALDH1A1HSP90AA1CCR6 | |
| SCHEMBL3543974 | 0.56 | MAPT (0.50) | NPSR1MAPTALDH1A1HSP90AA1CCR6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101965350-A | Novel pyrazolo [3,4-d ] pyrimidine derivatives as anticancer agents | NATCO PHARMA LTD | 2011-02-02 | — | — | CN | disclosed |
| EP-2247596-A2 | NOVEL PYRAZOLO [3, 4 -D] PYRIMIDINE DERIVATIVES AS ANTI -CANCER AGENTS | Natco Pharma Limited (IN) | 2010-11-10 | — | — | EP | disclosed |
| WO-2009098715-A2 | NOVEL PYRAZOLO [3, 4 -D] PYRIMIDINE DERIVATIVES AS ANTI -CANCER AGENTS | NATCO PHARMA LIMITED (IN) | 2009-08-13 | — | — | WO | disclosed |