Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.35 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 4/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6449836 | 0.70 | POLB (0.47) | TP53 | |
| SCHEMBL5662424 | 0.66 | GHSR (0.51) | — | |
| SCHEMBL4666817 | 0.64 | SPHK2 (0.47) | — | |
| SCHEMBL6444425 | 0.61 | DPP4 (0.40) | SLC6A2SLC6A4 | |
| SCHEMBL11823012 | 0.60 | HTR2A (0.45) | — | |
| SCHEMBL6442733 | 0.60 | DPP4 (0.55) | — | |
| SCHEMBL4766750 | 0.60 | DRD1 (0.53) | — | |
| SCHEMBL14399068 | 0.58 | MPO (0.63) | SCN8ASLC6A4ACHE | |
| SCHEMBL16269087 | 0.58 | DPP7 (0.61) | SLC6A4ACHE | |
| SCHEMBL7245746 | 0.57 | MPO (0.62) | SCN8ASLC6A4ACHE |
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-1604662-A1 | 1-[(3R)-Amino-4-(2-fluoro-phenyl)-butyl]-pyrrolidine-(2R)-carboxylic acid benzyl amine derivatives and related compounds as dipeptidyl peptidase IV (DPP-IV) inhibitors for the treatment of type 2 diabetes mellitus | Santhera Pharmaceuticals (Deutschland) Aktiengesellschaft (DE) | 2005-12-14 | — | — | EP | disclosed |