Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27479161 | 0.79 | FFAR3 (0.35) | — | |
| SCHEMBL20456241 | 0.77 | — | — | |
| SCHEMBL4370229 | 0.74 | MEN1 (0.40) | — | |
| SCHEMBL16798170 | 0.73 | — | — | |
| SCHEMBL2349667 | 0.70 | — | — | |
| SCHEMBL3530127 | 0.69 | — | — | |
| SCHEMBL825523 | 0.69 | — | — | |
| SCHEMBL27720460 | 0.67 | — | — | |
| SCHEMBL4283092 | 0.67 | — | — | |
| SCHEMBL319578 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-100383129-C | Beta-amino heterocyclic dipeptidyl peptidase inhibitors for the treatment or prevention of diabetes | MERCK & CO INC (US) | 2008-04-23 | — | — | CN | disclosed |
| CN-1705647-A | Beta-amino heterocyclic dipeptidyl peptidase inhibitors for the treatment or prevention of diabetes | MERCK & CO INC (US) | 2005-12-07 | — | — | CN | disclosed |