Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPC3 | Q13507 | 5/20 | 0.36 |
| ▸ | TRPC6 | Q9Y210 | 5/20 | 0.36 |
| ▸ | ATR | Q13535 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | CCNK | O75909 | 1/20 | 0.33 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.33 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | F10 | P00742 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20649200 | 1.00 | TRPC3 (0.36) | TRPC3TRPC6ATRTSHRL3MBTL1 | |
| SCHEMBL20649319 | 0.89 | F2 (0.45) | ATRF2F10ALDH1A1 | |
| SCHEMBL30183940 | 0.89 | F2 (0.45) | ATRF2F10ALDH1A1 | |
| SCHEMBL30183178 | 0.89 | F2 (0.45) | ATRF2F10ALDH1A1 | |
| SCHEMBL20649396 | 0.89 | F2 (0.45) | ATRF2F10ALDH1A1 | |
| SCHEMBL20649285 | 0.88 | ATR (0.36) | ATRL3MBTL1L3MBTL3RAB9ALRRK2 | |
| SCHEMBL30183031 | 0.88 | ATR (0.36) | ATRL3MBTL1L3MBTL3RAB9ALRRK2 | |
| SCHEMBL20649145 | 0.88 | ATR (0.31) | ATRF2F10 | |
| SCHEMBL30183497 | 0.88 | ATR (0.31) | ATRF2F10 | |
| SCHEMBL20649192 | 0.88 | F2 (0.46) | ATRF2F10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110997678-B | Pyrazoloquinazoline derivatives as choline kinase inhibitors | 内尔维亚诺医疗科学公司 | 2023-02-21 | — | — | CN | claimed |
| CN-110997678-B | Pyrazoloquinazoline derivatives as choline kinase inhibitors | 内尔维亚诺医疗科学公司 | 2023-02-21 | — | — | CN | disclosed |