Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1G | O43497 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | HTR3A | P46098 | 1/20 | 0.53 |
| ▸ | MMP13 | P45452 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.52 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | PRKACA | P17612 | 1/20 | 0.52 |
| ▸ | GSK3A | P49840 | 1/20 | 0.52 |
| ▸ | GSK3B | P49841 | 1/20 | 0.52 |
| ▸ | PRKX | P51817 | 1/20 | 0.52 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.52 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.52 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL4716615 | 0.92 | CYP2C9 (0.63) | ALDH1A1GAAPOLBMMP13CYP2C9 | |
| SCHEMBL5615595 | 0.87 | CYP2C9 (0.56) | ALDH1A1GAAMMP13CYP2C9ROCK2 | |
| SCHEMBL4716344 | 0.86 | CYP2C9 (0.69) | ALDH1A1POLBMMP13MAPTCYP2C9 | |
| SCHEMBL14602318 | 0.86 | MMP13 (0.59) | ALDH1A1MMP13CYP2C9ROCK2CYP3A4 | |
| SCHEMBL4720613 | 0.83 | ROCK1 (0.57) | MMP13CYP2C9ROCK2CYP3A4CYP2D6 | |
| SCHEMBL4718560 | 0.83 | MMP13 (0.57) | ALDH1A1GAAMMP13CYP2C9ROCK2 | |
| SCHEMBL4715297 | 0.83 | ROCK2 (0.71) | MMP13CYP2C9ROCK2CYP3A4CYP2D6 | |
| SCHEMBL5616129 | 0.83 | HDAC1 (0.69) | MMP13CYP2C9ROCK2CYP3A4CYP2D6 | |
| SCHEMBL5615877 | 0.82 | LMNA (0.51) | ALDH1A1GAAPOLBMMP13LMNA | |
| SCHEMBL4715755 | 0.82 | MMP13 (0.67) | CACNA1GALDH1A1POLBMMP13CYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1560815-B1 | NOVEL PYRIMIDINE-4,6-DICARBOXAMIDES FOR THE SELECTIVE INHIBITION OF COLLAGENASES | SANOFI AVENTIS DEUTSCHLAND (DE) | 2008-03-12 | — | — | EP | claimed |
| US-7166609-B2 | Pyrimidine-4,6-dicarboxylic acid diamides for selectively inhibiting collagenases | SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) | 2007-01-23 | — | — | US | disclosed |
| US-7166609-B2 | Pyrimidine-4,6-dicarboxylic acid diamides for selectively inhibiting collagenases | SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) | 2007-01-23 | — | — | US | disclosed |