Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.53 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.48 |
| ▸ | PDE5A | O76074 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | OGFRL1 | Q5TC84 | 1/20 | 0.44 |
| ▸ | HTR3A | P46098 | 1/20 | 0.43 |
| ▸ | PDE9A | O76083 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | CDK1 | P06493 | 2/20 | 0.42 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.42 |
| ▸ | SRC | P12931 | 4/20 | 0.42 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.41 |
| ▸ | TCF7L2 | Q9NQB0 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13944754 | 0.81 | HTR2C (0.53) | ACHEHRH4PDE5AHTR3AHTR2A | |
| SCHEMBL13944177 | 0.80 | HTR2C (0.57) | HRH4CTNNB1TCF7L2 | |
| SCHEMBL2786942 | 0.79 | HRH4 (0.54) | HRH4PDE5AKDM4EMAPTMAPK1 | |
| SCHEMBL13947559 | 0.78 | NR3C1 (0.44) | HRH4PDE5AKDM4ENPSR1CTNNB1 | |
| SCHEMBL13944749 | 0.77 | TP53 (0.56) | ACHE | |
| SCHEMBL13943298 | 0.75 | HTR2C (0.61) | HRH4PDE5AKDM4EMAPTMAPK1 | |
| SCHEMBL3644693 | 0.75 | HTR2C (0.58) | HRH4PDE5AHTR3AHTR2ADRD3 | |
| SCHEMBL13946820 | 0.74 | HTR2C (0.70) | HRH4PDE5AHTR3AHTR2ADRD3 | |
| SCHEMBL13944192 | 0.73 | HTR2C (0.60) | ACHEHRH4PDE5AKDM4EMAPT | |
| SCHEMBL13944184 | 0.72 | PDE2A (0.59) | HRH4HTR3ACTNNB1TCF7L2CCR4 |
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-2025678-A1 | Pyrazolo[3,4-d]pyrimidine compounds and their use as modulators of protein kinase | Oncalis AG (CH) | 2009-02-18 | — | — | EP | disclosed |