Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAK1 | Q13153 | 1/20 | 0.44 |
| ▸ | JAK2 | O60674 | 1/20 | 0.43 |
| ▸ | JAK1 | P23458 | 1/20 | 0.43 |
| ▸ | PDGFRB | P09619 | 8/20 | 0.43 |
| ▸ | PDGFRA | P16234 | 3/20 | 0.43 |
| ▸ | KIT | P10721 | 1/20 | 0.43 |
| ▸ | FLT3 | P36888 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.42 |
| ▸ | SUV39H1 | O43463 | 1/20 | 0.41 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.41 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4726373 | 0.90 | CYP1A2 (0.46) | PAK1JAK2JAK1PDGFRBPDGFRA | |
| SCHEMBL4583185 | 0.90 | CYP1A2 (0.49) | PAK1JAK2JAK1PDGFRBKIT | |
| SCHEMBL4583930 | 0.90 | CYP1A2 (0.52) | PAK1PDGFRBPDGFRAKITCYP1A2 | |
| SCHEMBL4583789 | 0.88 | PAK1 (0.49) | PAK1PDGFRBCYP1A2CYP2D6MEN1 | |
| SCHEMBL4728802 | 0.86 | PDGFRB (0.45) | PDGFRB | |
| SCHEMBL4583535 | 0.85 | CYP1A2 (0.52) | PDGFRBPDGFRAKITFLT3CYP1A2 | |
| SCHEMBL4729369 | 0.83 | ROCK2 (0.45) | PAK1PDGFRBKITCYP1A2CYP2D6 | |
| SCHEMBL4582925 | 0.81 | PAK1 (0.57) | PAK1PDGFRBKITCYP1A2CYP2D6 | |
| SCHEMBL4583131 | 0.81 | PDGFRB (0.53) | PAK1PDGFRBPDGFRACYP1A2CYP2D6 | |
| SCHEMBL4726802 | 0.81 | PAK1 (0.54) | PAK1PDGFRBCYP1A2CYP2D6MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008028690-A1 | 1-(HET)ARYL-3-[HETARYL-PIPERIDIN-4-YL]-THIOUREAS AS MODULATORS OF THE EP2 RECEPTOR | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2008-03-13 | — | — | WO | disclosed |