Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | PIP4K2C | Q8TBX8 | 2/20 | 0.38 |
| ▸ | CCNT1 | O60563 | 12/20 | 0.37 |
| ▸ | CDK9 | P50750 | 12/20 | 0.37 |
| ▸ | PIP4K2A | P48426 | 3/20 | 0.36 |
| ▸ | PIP4K2B | P78356 | 3/20 | 0.36 |
| ▸ | PIKFYVE | Q9Y2I7 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | UGCG | Q16739 | 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 | |
|---|---|---|---|---|
| SCHEMBL4379223 | 0.88 | PIP4K2C (0.42) | CYP1A2CYP2D6LMNAPIP4K2CCCNT1 | |
| SCHEMBL4376893 | 0.88 | CYP1A2 (0.39) | CYP1A2CYP2D6LMNAPIP4K2CCCNT1 | |
| SCHEMBL4382347 | 0.88 | PIP4K2C (0.40) | CYP1A2CYP2D6LMNAPIP4K2CCCNT1 | |
| SCHEMBL4373522 | 0.87 | PIP4K2C (0.46) | CYP1A2CYP2D6LMNAPIP4K2CCCNT1 | |
| SCHEMBL1243706 | 0.86 | PIP4K2C (0.40) | CYP1A2CYP2D6LMNAPIP4K2CCCNT1 | |
| SCHEMBL4378671 | 0.86 | ADORA2A (0.42) | CYP1A2CYP2D6LMNAPIP4K2CCCNT1 | |
| SCHEMBL1242023 | 0.86 | PIP4K2C (0.38) | CYP1A2CYP2D6LMNAPIP4K2CCCNT1 | |
| SCHEMBL4375735 | 0.84 | CYP1A2 (0.41) | CYP1A2CYP2D6LMNAPIP4K2CCCNT1 | |
| SCHEMBL4382316 | 0.84 | PIP4K2C (0.40) | CYP1A2CYP2D6LMNAPIP4K2CCCNT1 | |
| SCHEMBL4382541 | 0.84 | PIP4K2C (0.40) | CYP1A2CYP2D6LMNAPIP4K2CCCNT1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1763526-B1 | 4,6-DISUBSTITUTED PYRIMIDINES AND THEIR USE AS PROTEIN KINASE INHIBITORS | BAYER SCHERING PHARMA AG (DE) | 2009-06-24 | — | — | EP | claimed |