Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.46 |
| ▸ | ACHE | P22303 | 2/20 | 0.46 |
| ▸ | BACE1 | P56817 | 2/20 | 0.46 |
| ▸ | DPP4 | P27487 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 5/20 | 0.39 |
| ▸ | MC4R | P32245 | 1/20 | 0.39 |
| ▸ | TTK | P33981 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2839423 | 1.00 | BCHE (0.46) | BCHEACHEBACE1DPP4TP53 | |
| SCHEMBL13841884 | 0.95 | DRD2 (0.44) | BCHEACHEBACE1DPP4DRD2 | |
| SCHEMBL2821338 | 0.95 | DRD2 (0.44) | BCHEACHEBACE1DPP4DRD2 | |
| SCHEMBL2821782 | 0.92 | DPP4 (0.45) | DPP4SIGMAR1DRD2DRD4GRM5 | |
| SCHEMBL2819541 | 0.90 | BCHE (0.50) | BCHEACHEBACE1DPP4SIGMAR1 | |
| SCHEMBL2817174 | 0.90 | BCHE (0.50) | BCHEACHEBACE1DPP4SIGMAR1 | |
| SCHEMBL2818933 | 0.90 | BCHE (0.50) | BCHEACHEBACE1DPP4SIGMAR1 | |
| SCHEMBL2817089 | 0.90 | DPP4 (0.43) | DPP4SIGMAR1DRD2DRD4GRM5 | |
| SCHEMBL2820581 | 0.90 | BCHE (0.51) | BCHEACHEBACE1DPP4DRD2 | |
| SCHEMBL2817128 | 0.89 | DPP4 (0.45) | BCHEACHEBACE1DPP4SIGMAR1 |
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-2155672-B1 | PROLINAMIDE DERIVATIVES AS NK3 ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2010-10-27 | — | — | EP | disclosed |