Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 1/20 | 0.55 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.47 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.47 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 7/20 | 0.45 |
| ▸ | GSK3A | P49840 | 3/20 | 0.44 |
| ▸ | GSK3B | P49841 | 3/20 | 0.44 |
| ▸ | MGLL | Q99685 | 2/20 | 0.44 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 2/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP12 | P39900 | 1/20 | 0.41 |
| ▸ | MMP13 | P45452 | 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 | |
|---|---|---|---|---|
| SCHEMBL22987290 | 0.89 | AKT1 (0.69) | AKT1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL22987328 | 0.88 | AKT1 (0.57) | AKT1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL22915443 | 0.86 | AKT1 (0.68) | AKT1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL22915375 | 0.79 | AKT1 (0.70) | AKT1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL22915402 | 0.79 | AKT1 (0.70) | AKT1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL23627513 | 0.78 | CHRNB2 (0.48) | CHRNB2CHRNB4CHRNA3CHRNA4MMP8 | |
| SCHEMBL22987323 | 0.78 | AKT1 (0.66) | AKT1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL22987322 | 0.78 | AKT1 (0.69) | AKT1GSK3AGSK3BMGLLCTSS | |
| SCHEMBL22915395 | 0.76 | AKT1 (0.67) | AKT1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL22915441 | 0.76 | AKT1 (0.83) | AKT1CTSSCTSK |
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 |
|---|---|---|---|---|---|---|---|
| EP-3778653-A1 | NOVEL REACTIVE ALGINIC ACID DERIVATIVES | Mochida Pharmaceutical Co., Ltd. (JP) | 2021-02-17 | — | — | EP | disclosed |