Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLS | O94925 | 1/20 | 0.37 |
| ▸ | ACKR3 | P25106 | 4/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.34 |
| ▸ | HPGDS | O60760 | 3/20 | 0.34 |
| ▸ | DRD2 | P14416 | 4/20 | 0.33 |
| ▸ | DRD3 | P35462 | 4/20 | 0.33 |
| ▸ | BUB1 | O43683 | 1/20 | 0.33 |
| ▸ | PRKACG | P22612 | 1/20 | 0.33 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.33 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.33 |
| ▸ | ACSL5 | Q9ULC5 | 1/20 | 0.33 |
| ▸ | STK24 | Q9Y6E0 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | DRD4 | P21917 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3109192 | 0.95 | ACKR3 (0.40) | GLSACKR3CYP2C9MAPK14HPGDS | |
| SCHEMBL5245478 | 0.93 | ACKR3 (0.37) | GLSACKR3MAPK14DRD2DRD3 | |
| SCHEMBL3113676 | 0.87 | ACKR3 (0.41) | GLSACKR3MAPK14CNR1 | |
| SCHEMBL5248546 | 0.87 | DRD2 (0.37) | GLSACKR3HPGDSDRD2DRD3 | |
| SCHEMBL3102931 | 0.85 | TP53 (0.39) | CYP2C9DRD2DRD3DRD4 | |
| SCHEMBL5245243 | 0.85 | PRKAA2 (0.45) | DRD4 | |
| SCHEMBL3104911 | 0.85 | S1PR1 (0.41) | DRD2DRD3DRD4 | |
| SCHEMBL5244865 | 0.84 | ACKR3 (0.43) | GLSACKR3 | |
| SCHEMBL5247166 | 0.83 | EPHX2 (0.41) | — | |
| SCHEMBL5246041 | 0.83 | MIF (0.45) | GLSDRD2DRD3 |
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 |