Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 15/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.37 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.35 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | HTR3A | P46098 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17373622 | 0.89 | NOTUM (0.42) | NOTUMKEAP1HCRTR1HCRTR2CYP1A2 | |
| Hydrochloric Acid SCHEMBL23291644 | 0.87 | NOTUM (0.41) | NOTUMKEAP1HCRTR1HCRTR2CYP1A2 | |
| SCHEMBL170100 | 0.78 | IDO1 (0.47) | NOTUMKEAP1CYP1A2CYP2C9CHRNB2 | |
| SCHEMBL31245628 | 0.78 | IDO1 (0.47) | NOTUMKEAP1CYP1A2CYP2C9CHRNB2 | |
| SCHEMBL4071974 | 0.77 | NOTUM (0.46) | NOTUMKEAP1CYP19A1HCRTR1HCRTR2 | |
| Hydrochloric Acid SCHEMBL23291646 | 0.76 | IDO1 (0.46) | NOTUMKEAP1HCRTR1HCRTR2CYP1A2 | |
| SCHEMBL27613715 | 0.76 | NOTUM (0.44) | NOTUMKEAP1HCRTR1HCRTR2CYP1A2 | |
| SCHEMBL18284747 | 0.75 | NOTUM (0.46) | NOTUMKEAP1CYP19A1MAP3K5CYP1A2 | |
| SCHEMBL23291958 | 0.75 | NOTUM (0.39) | NOTUMKEAP1CYP19A1 | |
| Hydrochloric Acid SCHEMBL23292191 | 0.73 | NOTUM (0.38) | NOTUMKEAP1CYP19A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2118077-A2 | TRIAZOLE COMPOUNDS THAT MODULATE HSP90 ACTIVITY | Synta Pharmaceuticals Corporation (US) | 2009-11-18 | — | — | EP | disclosed |
| WO-2008097640-A2 | TRIAZOLE COMPOUNDS THAT ARE USEFUL IN THE TREATMENT OF PROLIFERATIVE DISORDERS, SUCH AS CANCER | SYNTA PHARMACEUTICALS CORP. (US) | 2008-08-14 | — | — | WO | disclosed |