Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 2/20 | 0.48 |
| ▸ | PIM1 | P11309 | 1/20 | 0.48 |
| ▸ | MARK3 | P27448 | 1/20 | 0.48 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.48 |
| ▸ | CAMK2B | Q13554 | 1/20 | 0.48 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.48 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13051131 | 0.87 | DYRK1A (0.42) | DYRK1APIM1MARK3MAP4K2CAMK2B | |
| SCHEMBL30847419 | 0.87 | CCNB2 (0.46) | DYRK1AHSP90AA1HSP90AB1AAK1 | |
| SCHEMBL27153842 | 0.87 | CCNB2 (0.46) | DYRK1AHSP90AA1HSP90AB1AAK1 | |
| SCHEMBL3052846 | 0.86 | AAK1 (0.38) | DYRK1APIM1MARK3MAP4K2CAMK2B | |
| SCHEMBL30076963 | 0.84 | PIM1 (0.49) | DYRK1APIM1MARK3MAP4K2CAMK2B | |
| SCHEMBL17683240 | 0.83 | HTT (0.55) | DYRK1ACREBBPMEN1KMT2ANPSR1 | |
| SCHEMBL30459782 | 0.83 | HTT (0.55) | DYRK1ACREBBPMEN1KMT2ANPSR1 | |
| SCHEMBL22911971 | 0.82 | PIM1 (0.50) | PIM1MARK3MAP4K2CAMK2BPIM3 | |
| SCHEMBL29595692 | 0.82 | PIM1 (0.50) | PIM1MARK3MAP4K2CAMK2BPIM3 | |
| SCHEMBL27029449 | 0.81 | ACHE (0.54) | DYRK1APIM1MARK3MAP4K2CAMK2B |
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-112480083-A | AZD9291 derivative containing alkynyl and preparation method and application thereof | 上海应用技术大学 | 2021-03-12 | — | — | CN | claimed |
| CN-112480083-A | AZD9291 derivative containing alkynyl and preparation method and application thereof | 上海应用技术大学 | 2021-03-12 | — | — | CN | disclosed |