Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 5/20 | 0.38 |
| ▸ | DRD3 | P35462 | 5/20 | 0.38 |
| ▸ | DGAT1 | O75907 | 4/20 | 0.38 |
| ▸ | MIF | P14174 | 2/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | DDT | P30046 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5246426 | 0.91 | BRD4 (0.41) | DRD2DRD3DGAT1MIFDRD4 | |
| SCHEMBL3104911 | 0.90 | S1PR1 (0.41) | DRD2DRD3DGAT1DRD4 | |
| Trifluoroacetic Acid SCHEMBL5248782 | 0.90 | SCN9A (0.38) | DRD2DRD3DGAT1DRD4 | |
| SCHEMBL5246041 | 0.89 | MIF (0.45) | DRD2DRD3MIFDDT | |
| SCHEMBL3102931 | 0.89 | TP53 (0.39) | DRD2DRD3DRD4MAPK1 | |
| SCHEMBL5250335 | 0.87 | SMN1; SMN2 (0.45) | DRD2DRD3DGAT1MIF | |
| SCHEMBL5244507 | 0.86 | BRD4 (0.40) | DRD2DRD3MIFROCK2 | |
| Trifluoroacetic Acid SCHEMBL5246340 | 0.86 | NPC1 (0.38) | DRD2DRD3RIPK1 | |
| SCHEMBL3109192 | 0.86 | ACKR3 (0.40) | DRD2DRD3 | |
| SCHEMBL5248546 | 0.85 | DRD2 (0.37) | DRD2DRD3DRD4 |
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 |