Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 1/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | F13A1 | P00488 | 1/20 | 0.42 |
| ▸ | TGM2 | P21980 | 1/20 | 0.42 |
| ▸ | TGM1 | P22735 | 1/20 | 0.42 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.40 |
| ▸ | MIF | P14174 | 1/20 | 0.40 |
| ▸ | BCL2 | P10415 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.39 |
| ▸ | ATR | Q13535 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Ethoxycarbonyl Group SCHEMBL31274185 | 0.90 | NAMPT (0.38) | NAMPTGRIN2BHDAC1GSK3BDYRK1A | |
| SCHEMBL479056 | 0.87 | NAMPT (0.43) | NAMPTGRIN2BHDAC1GSK3BDYRK1A | |
| SCHEMBL5689275 | 0.85 | NPC1 (0.41) | RAB9ANPC1SMN1; SMN2MAPTKDM4E | |
| SCHEMBL28579578 | 0.84 | HDAC1 (0.41) | NAMPTGRIN2BHDAC1GSK3BDYRK1A | |
| SCHEMBL21375791 | 0.84 | HDAC1 (0.41) | NAMPTGRIN2BHDAC1GSK3BDYRK1A | |
| SCHEMBL29636747 | 0.84 | HDAC1 (0.41) | NAMPTGRIN2BHDAC1GSK3BDYRK1A | |
| SCHEMBL19398230 | 0.83 | RAB9A (0.45) | NAMPTGRIN2BHDAC1GSK3BDYRK1A | |
| SCHEMBL12143915 | 0.82 | HDAC1 (0.40) | NAMPTGRIN2BHDAC1GSK3BDYRK1A | |
| SCHEMBL2035206 | 0.81 | KDR (0.44) | GRIN2BRAB9ANPC1SMN1; SMN2MAPT | |
| SCHEMBL2307440 | 0.81 | GSK3B (0.44) | NAMPTGRIN2BHDAC1GSK3BDYRK1A |
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-113444036-B | Diarylethylene derivative and preparation method and application thereof | 首都医科大学脑重大疾病研究中心(北京脑重大疾病研究院) | 2022-10-04 | — | — | CN | disclosed |
| CN-113444036-A | Diarylethylene derivative and preparation method and application thereof | 首都医科大学脑重大疾病研究中心(北京脑重大疾病研究院) | 2021-09-28 | — | — | CN | disclosed |