Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 9/20 | 0.36 |
| ▸ | JAK2 | O60674 | 7/20 | 0.36 |
| ▸ | PDE2A | O00408 | 1/20 | 0.30 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.30 |
| ▸ | JAK1 | P23458 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22018072 | 0.92 | NTRK1 (0.38) | NTRK1JAK2GPR119 | |
| SCHEMBL21986931 | 0.83 | NTRK1 (0.36) | NTRK1JAK2 | |
| SCHEMBL21986930 | 0.83 | NTRK1 (0.36) | NTRK1JAK2 | |
| SCHEMBL21986929 | 0.83 | NTRK1 (0.36) | NTRK1JAK2 | |
| SCHEMBL20691645 | 0.83 | DRD3 (0.43) | GPR119 | |
| SCHEMBL20691686 | 0.77 | NTRK1 (0.37) | NTRK1JAK2 | |
| SCHEMBL22018066 | 0.76 | NTRK1 (0.34) | NTRK1JAK2JAK1 | |
| SCHEMBL20691552 | 0.76 | NTRK1 (0.36) | NTRK1JAK2 | |
| SCHEMBL22018067 | 0.73 | DRD3 (0.42) | GPR119 | |
| SCHEMBL23778901 | 0.72 | HRH4 (0.39) | NTRK1JAK2 |
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-3660018-A1 | PIPERAZINE HETEROARYL DERIVATIVE, PREPARATION METHOD THEREFOR AND USE OF SAME IN MEDICINE | Jiangsu Hengrui Medicine Co., Ltd. (CN) | 2020-06-03 | — | — | EP | disclosed |