Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 2/20 | 0.44 |
| ▸ | DRD4 | P21917 | 2/20 | 0.44 |
| ▸ | DRD3 | P35462 | 2/20 | 0.44 |
| ▸ | DCTPP1 | Q9H773 | 4/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.39 |
| ▸ | ATR | Q13535 | 1/20 | 0.38 |
| ▸ | BTK | Q06187 | 1/20 | 0.37 |
| ▸ | AKT1 | P31749 | 6/20 | 0.37 |
| ▸ | AKT2 | P31751 | 6/20 | 0.37 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.37 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.36 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19202672 | 0.84 | BTK (0.50) | DRD2DRD4DRD3BTKHRH3 | |
| SCHEMBL24083375 | 0.79 | BTK (0.57) | DRD2DRD4DRD3DCTPP1ATR | |
| SCHEMBL24083366 | 0.73 | BTK (0.70) | BTK | |
| SCHEMBL24083370 | 0.72 | BTK (0.51) | BTK | |
| SCHEMBL24083387 | 0.71 | BTK (0.46) | BTK | |
| SCHEMBL24083393 | 0.64 | TNK2 (0.45) | BTK | |
| SCHEMBL24083385 | 0.64 | BTK (0.41) | BTK | |
| SCHEMBL24083394 | 0.64 | BTK (0.52) | BTK | |
| SCHEMBL6975763 | 0.62 | DRD2 (0.86) | DRD2DRD4DRD3ADORA2AADORA1 | |
| SCHEMBL1387890 | 0.61 | DRD4 (1.00) | DRD2DRD4DRD3 |
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-2017128917-A1 | PARAZOLE CONDENSED-RING DERIVATIVES AND PREPARATION METHOD THEREOF AND APPLICATION THEREOF IN TREATMENT OF CANCERS, INFLAMMATION AND IMMUNE DISEASES | 北京诺诚健华医药科技有限公司 | 2017-08-03 | — | — | WO | disclosed |