Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 4/20 | 0.41 |
| ▸ | ACACB | O00763 | 6/20 | 0.38 |
| ▸ | ACACA | Q13085 | 6/20 | 0.38 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.36 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.36 |
| ▸ | VCP | P55072 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4420489 | 0.97 | GSK3B (0.40) | GSK3BACACBACACAITGB3ITGA2B | |
| SCHEMBL4420806 | 0.96 | ACACB (0.42) | GSK3BACACBACACAALDH1A1KDM4E | |
| SCHEMBL4422560 | 0.95 | GSK3B (0.40) | GSK3BACACBACACAITGB3ITGA2B | |
| SCHEMBL4424995 | 0.92 | GSK3B (0.39) | GSK3BACACBACACAITGB3ITGA2B | |
| SCHEMBL4424997 | 0.91 | ACACB (0.39) | GSK3BACACBACACAITGB3ITGA2B | |
| SCHEMBL5554395 | 0.90 | GSK3B (0.44) | GSK3BALDH1A1CYP1A2CYP2D6TSHR | |
| SCHEMBL3366965 | 0.90 | GSK3B (0.47) | GSK3BALDH1A1CYP1A2CYP2D6TSHR | |
| SCHEMBL3368275 | 0.89 | GSK3B (0.46) | GSK3BALDH1A1CYP1A2CYP2D6TSHR | |
| SCHEMBL3364367 | 0.89 | GSK3B (0.46) | GSK3BALDH1A1CYP1A2CYP2D6TSHR | |
| SCHEMBL5554655 | 0.87 | GSK3B (0.43) | GSK3BACACBACACAITGB3ITGA2B |
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 |
| EP-1699795-B1 | SUBSTITUTED 8'-PYRI(MI)DINYL-DIHYDROSPIRO-[CYCLOALKLYMINE]-PYRIMIDO[1,2A]PYRIMIDIN-6-ONE DERIVATIVES | SANOFI AVENTIS (FR) | 2007-04-25 | — | — | EP | disclosed |