Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | PCNA | P12004 | 1/20 | 0.43 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ICMT | O60725 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6583906 | 0.86 | SRC (0.44) | AMY1APCNACSNK2A1TRPA1ALOX15 | |
| SCHEMBL3133362 | 0.84 | EGFR (0.47) | PCNATP53TDP1ALOX15HSD17B10 | |
| SCHEMBL27500492 | 0.84 | TAAR1 (0.44) | HTTHSD17B10NPSR1LMNAHPGD | |
| SCHEMBL24804887 | 0.81 | PCNA (0.46) | PCNATDP1ALDH1A1MEN1GAA | |
| SCHEMBL30772157 | 0.81 | POLB (0.46) | HTTPCNAANO1ALOX15ALDH1A1 | |
| SCHEMBL3880143 | 0.81 | HIF1A (0.53) | HTTANO1ALOX15HSD17B10LMNA | |
| SCHEMBL3823395 | 0.81 | PCNA (0.43) | HTTPCNAALOX15HSD17B10ALDH1A1 | |
| SCHEMBL27745589 | 0.79 | SRC (0.56) | AMY1AHTTCSNK2A1TRPA1TP53 | |
| SCHEMBL10421373 | 0.78 | ALDH1A1 (0.47) | PCNATDP1ALDH1A1HPGDKDM4E | |
| SCHEMBL30148651 | 0.78 | EGFR (0.43) | PCNATDP1ANO1ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| 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 |