Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 10/20 | 0.35 |
| ▸ | CDC7 | O00311 | 4/20 | 0.35 |
| ▸ | PIM1 | P11309 | 3/20 | 0.35 |
| ▸ | HIPK2 | Q9H2X6 | 3/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.35 |
| ▸ | PRKACA | P17612 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | IRAK4 | Q9NWZ3 | 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 | |
|---|---|---|---|---|
| SCHEMBL4429026 | 0.94 | ALDH1A1 (0.38) | ALDH1A1TSHRKDM4EGLAHTT | |
| SCHEMBL4421551 | 0.86 | CDC7 (0.46) | ALDH1A1TSHRKDM4EHTTSMN1; SMN2 | |
| SCHEMBL4418556 | 0.85 | GSK3B (0.42) | KDM5BGSK3BCDC7PIM1HIPK2 | |
| SCHEMBL4428471 | 0.82 | CDC7 (0.44) | ALDH1A1TSHRKDM4EGLAHTT | |
| SCHEMBL4420558 | 0.80 | GSK3B (0.39) | GSK3BCYP46A1 | |
| SCHEMBL4420553 | 0.80 | GSK3B (0.39) | GSK3BCYP46A1 | |
| SCHEMBL4867552 | 0.79 | KDM5B (0.41) | KDM5BGSK3BCDC7PIM1HIPK2 | |
| SCHEMBL3959225 | 0.75 | CYP2C9 (0.37) | ALDH1A1KDM4EKDM5BCYP2C9GSK3B | |
| SCHEMBL5432029 | 0.74 | GSK3B (0.42) | ALDH1A1TSHRCYP2C9GSK3BCYP46A1 | |
| SCHEMBL4000370 | 0.73 | CDC7 (0.51) | ALDH1A1KDM4EKDM5BGSK3BCDC7 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |