Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKT1 | P31749 | 1/20 | 0.57 |
| ▸ | GSK3A | P49840 | 3/20 | 0.49 |
| ▸ | GSK3B | P49841 | 3/20 | 0.49 |
| ▸ | MGLL | Q99685 | 2/20 | 0.49 |
| ▸ | MMP8 | P22894 | 8/20 | 0.47 |
| ▸ | FAAH | O00519 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 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 | |
|---|---|---|---|---|
| SCHEMBL22987322 | 0.88 | AKT1 (0.69) | AKT1GSK3AGSK3BMGLLFAAH | |
| SCHEMBL22987210 | 0.88 | AKT1 (0.55) | AKT1GSK3AGSK3BMGLLMMP8 | |
| SCHEMBL22915443 | 0.79 | AKT1 (0.68) | AKT1MMP8MMP1MMP9CHRNB2 | |
| SCHEMBL22915431 | 0.78 | AKT1 (0.66) | AKT1GSK3AGSK3BMGLLCYP2D6 | |
| SCHEMBL24765686 | 0.78 | AKT1 (0.66) | AKT1GSK3AGSK3BMGLLCYP2D6 | |
| SCHEMBL22987290 | 0.78 | AKT1 (0.69) | AKT1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL22915399 | 0.77 | AKT1 (0.71) | AKT1GSK3AGSK3BMGLLTSHR | |
| SCHEMBL22915374 | 0.77 | AKT1 (0.71) | AKT1GSK3AGSK3BMGLLTSHR | |
| SCHEMBL22987323 | 0.76 | AKT1 (0.66) | AKT1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL29652101 | 0.75 | GSK3A (0.58) | GSK3AGSK3BMGLLFAAHKMT2A |
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 |