Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 5/20 | 0.41 |
| ▸ | GSK3A | P49840 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | ELANE | P08246 | 1/20 | 0.36 |
| ▸ | CTSG | P08311 | 1/20 | 0.36 |
| ▸ | CTRC | Q99895 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 2/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.33 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.33 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7516771 | 0.81 | ADORA2B (0.37) | GSK3BGSK3AALDH1A1MAPTKDM4E | |
| SCHEMBL339514 | 0.71 | SIRT2 (0.33) | ADORA2AADORA2BSIRT2SIRT1SIRT3 | |
| SCHEMBL12715828 | 0.71 | ALDH1A1 (0.47) | GSK3BGSK3AALDH1A1MAPTKDM4E | |
| SCHEMBL12660972 | 0.69 | F2 (0.40) | GSK3BGSK3AALDH1A1MAPTKDM4E | |
| SCHEMBL23020227 | 0.69 | GSK3A (0.50) | GSK3BGSK3AADORA2AADORA2BCYP1A2 | |
| SCHEMBL21974369 | 0.69 | GSK3A (0.50) | GSK3BGSK3AADORA2AADORA2BCYP1A2 | |
| SCHEMBL633733 | 0.69 | CYP1A2 (0.47) | GSK3BGSK3AALDH1A1MAPTKDM4E | |
| SCHEMBL26452124 | 0.69 | GSK3B (0.39) | GSK3BGSK3AALDH1A1MAPTKDM4E | |
| SCHEMBL28475407 | 0.67 | — | — | |
| SCHEMBL18999295 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-11335356-A | — | — | None | — | — | JP | disclosed |
| JP-H11335356-A | CYCLIC UREA COMPOUND AND ITS PRODUCTION | MITSUI CHEM INC | 1999-12-07 | — | — | JP | disclosed |