Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 11/20 | 0.38 |
| ▸ | DRD3 | P35462 | 8/20 | 0.38 |
| ▸ | DRD4 | P21917 | 4/20 | 0.38 |
| ▸ | BRD4 | O60885 | 2/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | ACKR3 | P25106 | 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 | |
|---|---|---|---|---|
| SCHEMBL3113676 | 0.91 | ACKR3 (0.41) | BRD4CNR2ACKR3 | |
| SCHEMBL5248546 | 0.91 | DRD2 (0.37) | DRD2DRD3DRD4ACKR3 | |
| SCHEMBL5245478 | 0.86 | ACKR3 (0.37) | DRD2DRD3BRD4ACKR3 | |
| SCHEMBL3110965 | 0.86 | ACKR3 (0.43) | BRD4CNR2ACKR3 | |
| SCHEMBL5246426 | 0.85 | BRD4 (0.41) | DRD2DRD3DRD4BRD4 | |
| SCHEMBL5246767 | 0.85 | MIF (0.47) | BRD4 | |
| SCHEMBL3111860 | 0.85 | ACKR3 (0.40) | BRD4CNR2ACKR3 | |
| SCHEMBL3107872 | 0.84 | CNR2 (0.41) | BRD4CNR2ACKR3 | |
| Trifluoroacetic Acid SCHEMBL5246942 | 0.83 | PRKAA2 (0.43) | DRD4 | |
| SCHEMBL5244706 | 0.83 | ROCK2 (0.40) | BRD4 |
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-1867331-A1 | TRIAZOLE DERIVATIVE AND THE USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2007-12-19 | — | — | EP | disclosed |