Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.48 |
| ▸ | BACE1 | P56817 | 3/20 | 0.48 |
| ▸ | BCHE | P06276 | 2/20 | 0.48 |
| ▸ | DRD4 | P21917 | 2/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA4 | P22748 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4659230 | 0.84 | CCR2 (0.49) | DRD4SIGMAR1ALDH1A1 | |
| SCHEMBL29277635 | 0.83 | SIGMAR1 (0.56) | SIGMAR1ALDH1A1LMNA | |
| SCHEMBL18893936 | 0.81 | LMNA (0.58) | SIGMAR1ALDH1A1LMNA | |
| SCHEMBL13225693 | 0.79 | CA2 (0.55) | ACHEBACE1BCHEDRD4DRD2 | |
| SCHEMBL3495202 | 0.79 | CA2 (0.57) | ACHEBACE1BCHEDRD4DRD2 | |
| SCHEMBL3506136 | 0.78 | NR1H2 (0.54) | ACHEBACE1BCHESIGMAR1CA1 | |
| SCHEMBL3495123 | 0.78 | NR1H2 (0.54) | ACHEBACE1BCHESIGMAR1CA1 | |
| SCHEMBL29245975 | 0.76 | SIGMAR1 (0.46) | DRD4DRD2SIGMAR1ALDH1A1LMNA | |
| SCHEMBL22959569 | 0.76 | SLC6A2 (0.40) | — | |
| SCHEMBL22966395 | 0.76 | SLC6A2 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1999117-A2 | RENIN INHIBITORS | Takeda Pharmaceutical Company Limited (JP) | 2008-12-10 | — | — | EP | disclosed |
| WO-2007117961-A2 | RENIN INHIBITORS | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-10-18 | — | — | WO | disclosed |