Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | JAK2 | O60674 | 1/20 | 0.51 |
| ▸ | PAK4 | O96013 | 1/20 | 0.51 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.51 |
| ▸ | LCK | P06239 | 1/20 | 0.51 |
| ▸ | FYN | P06241 | 1/20 | 0.51 |
| ▸ | CSF1R | P07333 | 1/20 | 0.51 |
| ▸ | RET | P07949 | 1/20 | 0.51 |
| ▸ | MET | P08581 | 1/20 | 0.51 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.51 |
| ▸ | PIM1 | P11309 | 1/20 | 0.51 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.51 |
| ▸ | PRKACA | P17612 | 1/20 | 0.51 |
| ▸ | GRK5 | P34947 | 1/20 | 0.51 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.51 |
| ▸ | FLT3 | P36888 | 1/20 | 0.51 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.51 |
| ▸ | CDK8 | P49336 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL10084487 | 0.88 | HSD17B10 (0.55) | HSD17B10ALDH1A1SMN1; SMN2GAAMAPT | |
| SCHEMBL4743261 | 0.82 | HSD17B10 (0.69) | HSD17B10ALDH1A1SMN1; SMN2GAAMAPT | |
| SCHEMBL11548717 | 0.81 | HSD17B10 (0.61) | HSD17B10ALDH1A1SMN1; SMN2GAAMAPT | |
| SCHEMBL12940747 | 0.81 | HSD17B10 (0.67) | HSD17B10ALDH1A1SMN1; SMN2JAK2PAK4 | |
| SCHEMBL17298090 | 0.80 | TNKS2 (0.62) | ALDH1A1SMN1; SMN2PIM1FLT3GAA | |
| SCHEMBL8197895 | 0.80 | ALDH1A1 (0.62) | HSD17B10ALDH1A1SMN1; SMN2GAAMAPT | |
| SCHEMBL30208243 | 0.80 | ALDH1A1 (0.62) | HSD17B10ALDH1A1SMN1; SMN2GAAMAPT | |
| SCHEMBL3110721 | 0.74 | KDM4E (0.56) | SMN1; SMN2PIM1FLT3GAAMAPT | |
| SCHEMBL19104692 | 0.74 | TUBB4A (0.48) | HSD17B10ALDH1A1SMN1; SMN2PIM1FLT3 | |
| SCHEMBL3840420 | 0.73 | HSD17B10 (0.71) | HSD17B10ALDH1A1SMN1; SMN2GAAMAPT |
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-117580836-A | Pyrimidine ring structure derivative and application thereof | 四川汇宇制药股份有限公司 | 2024-02-20 | — | — | CN | disclosed |
| WO-2022268209-A1 | DERIVATIVE HAVING PYRIMIDINE-FUSED CYCLIC STRUCTURE, AND USE THEREOF | 四川汇宇制药股份有限公司 | 2022-12-29 | — | — | WO | disclosed |
| WO-2022268209-A1 | DERIVATIVE HAVING PYRIMIDINE-FUSED CYCLIC STRUCTURE, AND USE THEREOF | 四川汇宇制药股份有限公司 | 2022-12-29 | — | — | WO | disclosed |