Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.48 |
| ▸ | NUDT1 | P36639 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.42 |
| ▸ | PRKCI | P41743 | 3/20 | 0.41 |
| ▸ | AXL | P30530 | 1/20 | 0.41 |
| ▸ | IKBKB | O14920 | 2/20 | 0.41 |
| ▸ | CHUK | O15111 | 2/20 | 0.41 |
| ▸ | JAK2 | O60674 | 2/20 | 0.41 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.41 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | PAK4 | O96013 | 1/20 | 0.41 |
| ▸ | CSF1R | P07333 | 1/20 | 0.41 |
| ▸ | RET | P07949 | 1/20 | 0.41 |
| ▸ | IGF1R | P08069 | 1/20 | 0.41 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.41 |
| ▸ | PRKACA | P17612 | 1/20 | 0.41 |
| ▸ | FLT1 | P17948 | 1/20 | 0.41 |
| ▸ | LTK | P29376 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL22493827 | 0.85 | NUDT1 (0.47) | NOTUMNUDT1PRKCIAXLIKBKB | |
| SCHEMBL31280881 | 0.82 | NUDT1 (0.56) | NOTUMNUDT1ALDH1A1IKBKBCHUK | |
| SCHEMBL23663615 | 0.82 | NUDT1 (0.56) | NOTUMNUDT1ALDH1A1IKBKBCHUK | |
| SCHEMBL28453832 | 0.79 | SLC22A12 (0.44) | NUDT1ALDH1A1SLC22A12KDM4EPRNP | |
| SCHEMBL28937038 | 0.77 | ALDH1A1 (0.43) | ALDH1A1SLC22A12KDM4EPRNPRXFP1 | |
| SCHEMBL12605518 | 0.75 | PARP1 (0.56) | NOTUMNUDT1PRKCIAXLIKBKB | |
| SCHEMBL2878621 | 0.72 | PARP1 (0.47) | NOTUMNUDT1PRKCIAXLIKBKB | |
| SCHEMBL28408913 | 0.70 | ALDH1A1 (0.47) | ALDH1A1SLC22A12KDM4EPRNPRXFP1 | |
| SCHEMBL28922385 | 0.69 | NOTUM (0.50) | NOTUMALDH1A1SLC22A12KDM4EPRNP | |
| SCHEMBL1456822 | 0.68 | NUDT1 (0.60) | NOTUMNUDT1PRKCIAXLIKBKB |
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-114981268-A | Pyrimidine-4 (3H) -ketone heterocyclic compound, preparation method and application thereof in medicine and pharmacology | 北京诺诚健华医药科技有限公司 | 2022-08-30 | — | — | CN | disclosed |
| CN-113135910-A | Pyrimidine-4 (3H) -ketone heterocyclic compound, preparation method and pharmaceutical application thereof | 北京诺诚健华医药科技有限公司 | 2021-07-20 | — | — | CN | disclosed |