Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A9 | P48067 | 1/20 | 0.47 |
| ▸ | CYP11B2 | P19099 | 11/20 | 0.44 |
| ▸ | KDR | P35968 | 2/20 | 0.42 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL18790973 | 0.82 | CYP11B2 (0.43) | CYP11B2CYP11B1SMN1; SMN2 | |
| SCHEMBL25270964 | 0.81 | S1PR1 (0.44) | CYP11B2DRD2GFERSMN1; SMN2DRD4 | |
| SCHEMBL18791041 | 0.78 | CYP11B2 (0.45) | CYP11B2KDRCYP11B1 | |
| SCHEMBL18791027 | 0.78 | CYP11B2 (0.48) | CYP11B2CYP11B1DRD2DRD4 | |
| SCHEMBL18791026 | 0.78 | GAA (0.53) | CYP11B2CYP11B1DRD2DRD4 | |
| SCHEMBL18790697 | 0.77 | CYP11B2 (0.69) | CYP11B2KDRCYP11B1DRD2DRD4 | |
| SCHEMBL18790706 | 0.77 | CYP11B2 (0.72) | CYP11B2CYP11B1 | |
| SCHEMBL18791106 | 0.75 | CYP11B2 (0.53) | CYP11B2CYP11B1DRD2SMN1; SMN2DRD4 | |
| SCHEMBL18790971 | 0.74 | CYP11B2 (0.44) | CYP11B2CYP11B1SMN1; SMN2 | |
| SCHEMBL20271722 | 0.73 | SMN1; SMN2 (0.68) | SLC6A9GFERSMN1; SMN2DRD4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017069226-A1 | NOVEL NITROGEN-CONTAINING AROMATIC HETEROCYCLIC COMPOUND | 田辺三菱製薬株式会社 | 2017-04-27 | — | — | WO | disclosed |