Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR4 | P51679 | 15/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | INPPL1 | O15357 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16692263 | 0.81 | CCR4 (0.45) | CCR4ESR1ESR2DPP4INPPL1 | |
| SCHEMBL16258707 | 0.79 | CCR4 (0.55) | CCR4ESR1ESR2DPP4INPPL1 | |
| SCHEMBL16692262 | 0.75 | CCR4 (0.46) | CCR4ESR1ESR2MEN1KMT2A | |
| SCHEMBL16242164 | 0.72 | CCR4 (0.45) | CCR4 | |
| SCHEMBL16242132 | 0.69 | CCR4 (0.44) | CCR4MEN1KMT2A | |
| SCHEMBL16242226 | 0.67 | CCR4 (0.45) | CCR4 | |
| SCHEMBL13780220 | 0.67 | HRH4 (0.43) | CCR4ESR1ESR2KMT2AHTR2A | |
| SCHEMBL16242162 | 0.67 | CCR4 (0.44) | CCR4 | |
| SCHEMBL16242163 | 0.67 | CCR4 (0.41) | CCR4MEN1KMT2A | |
| SCHEMBL16258760 | 0.66 | CCR4 (0.44) | CCR4MEN1KMT2A |
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-2805947-B1 | PIPERAZINYL PYRIMIDINE DERIVATIVES, PREPARATION METHOD AND USE THEREOF | INST PHARMACOLOGY & TOXICOLOGY ACAD MILITARY MEDICAL SCIENCES PLA CHINA (CN) | 2017-02-22 | — | — | EP | disclosed |