Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 2/20 | 0.39 |
| ▸ | ACACA | Q13085 | 2/20 | 0.39 |
| ▸ | GSK3B | P49841 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | USP19 | O94966 | 4/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.34 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4424995 | 0.98 | GSK3B (0.39) | ACACBACACAGSK3BKDM4EMEN1 | |
| SCHEMBL4422560 | 0.96 | GSK3B (0.40) | ACACBACACAGSK3BKDM4EMEN1 | |
| SCHEMBL4420806 | 0.95 | ACACB (0.42) | ACACBACACAGSK3BKDM4EMEN1 | |
| SCHEMBL4420489 | 0.93 | GSK3B (0.40) | ACACBACACAGSK3BKDM4EMEN1 | |
| SCHEMBL5559490 | 0.91 | GSK3B (0.41) | ACACBACACAGSK3BKDM4EMEN1 | |
| SCHEMBL4425247 | 0.90 | GSK3B (0.42) | GSK3BKDM4EMEN1ALDH1A1HPGD | |
| SCHEMBL4432305 | 0.89 | GSK3B (0.43) | GSK3BALDH1A1USP19CYP2C9 | |
| SCHEMBL4421963 | 0.88 | GSK3B (0.40) | ACACBACACAGSK3BUSP19CYP2C9 | |
| SCHEMBL4421961 | 0.88 | GSK3B (0.40) | ACACBACACAGSK3BUSP19CYP2C9 | |
| SCHEMBL4418561 | 0.88 | GSK3B (0.42) | GSK3BHRH3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1699795-B1 | SUBSTITUTED 8'-PYRI(MI)DINYL-DIHYDROSPIRO-[CYCLOALKLYMINE]-PYRIMIDO[1,2A]PYRIMIDIN-6-ONE DERIVATIVES | SANOFI AVENTIS (FR) | 2007-04-25 | — | — | EP | claimed |
| US-7547705-B2 | Substituted 8′-pyri(MI)dinyl-dihydrospiro-[cycloalkylamine]-pyrimido[1,2-a]pyrimidin-6-one derivatives | SANOFI-AVENTIS (FR) | 2009-06-16 | — | — | US | disclosed |