Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.30 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8204281 | 0.85 | TSHR (0.34) | TSHRSMN1; SMN2 | |
| SCHEMBL3508923 | 0.83 | TYR (0.40) | SMN1; SMN2 | |
| SCHEMBL733676 | 0.81 | MMP1 (0.36) | TSHRSMN1; SMN2 | |
| SCHEMBL1244145 | 0.76 | ALDH1A1 (0.36) | SMN1; SMN2 | |
| SCHEMBL732854 | 0.76 | ALDH1A1 (0.36) | SMN1; SMN2 | |
| SCHEMBL10987110 | 0.76 | CASP1 (0.43) | — | |
| SCHEMBL9541479 | 0.76 | TSHR (0.41) | TSHRSMN1; SMN2GRIK1GRIK2 | |
| SCHEMBL2894392 | 0.76 | MAPT (0.40) | SMN1; SMN2 | |
| SCHEMBL732872 | 0.76 | ALDH1A1 (0.38) | SMN1; SMN2 | |
| SCHEMBL3495343 | 0.76 | ALDH1A1 (0.38) | SMN1; SMN2 |
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-2007016441-A1 | MACROCYCLIC PEPTIDES AS HCV NS3 PROTEASE INHIBITORS | MERCK & CO., INC. (US) | 2007-02-08 | — | — | WO | disclosed |