Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.47 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.45 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.45 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.45 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.42 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.40 |
| ▸ | KMO | O15229 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | CTSS | P25774 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2611136 | 0.77 | ABCC9 (0.52) | SMN1; SMN2LRRK2ABCC9ABCC8KCNJ11 | |
| SCHEMBL3348708 | 0.76 | SMN1; SMN2 (0.50) | SMN1; SMN2LRRK2ABCC9ABCC8KCNJ11 | |
| SCHEMBL5949403 | 0.75 | NOTUM (0.53) | NOTUMS1PR1PDE3BPDE3ACTSS | |
| SCHEMBL30742957 | 0.75 | NOTUM (0.53) | NOTUMS1PR1PDE3BPDE3ACTSS | |
| SCHEMBL30742956 | 0.75 | NOTUM (0.53) | NOTUMS1PR1PDE3BPDE3ACTSS | |
| SCHEMBL5949422 | 0.73 | AR (0.52) | NOTUMS1PR1PDE3BPDE3ACTSS | |
| SCHEMBL6608811 | 0.72 | SMN1; SMN2 (0.50) | SMN1; SMN2ABCC9ABCC8KCNJ11KCNJ8 | |
| SCHEMBL1073103 | 0.72 | GPBAR1 (0.40) | ABCC9ABCC8KCNJ11KCNJ8NOTUM | |
| SCHEMBL13028853 | 0.71 | SMN1; SMN2 (0.52) | SMN1; SMN2ABCC9ABCC8KCNJ11KCNJ8 | |
| SCHEMBL1556268 | 0.71 | ABCC9 (0.44) | SMN1; SMN2LRRK2ABCC9ABCC8KCNJ11 |
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-2271639-A2 | FUNGICIDE HYDROXIMOYL-TETRAZOLE DERIVATIVES | Bayer CropScience AG (DE) | 2011-01-12 | — | — | EP | disclosed |