Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 2/20 | 0.47 |
| ▸ | ACACA | Q13085 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | PPARD | Q03181 | 1/20 | 0.40 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.39 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | TEAD1 | P28347 | 1/20 | 0.37 |
| ▸ | TEAD3 | Q99594 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4682048 | 0.93 | ACACB (0.48) | ACACBACACATSHRSMN1; SMN2KCNH2 | |
| SCHEMBL4682448 | 0.93 | ACACB (0.48) | ACACBACACASMN1; SMN2KCNH2PPARG | |
| SCHEMBL16959700 | 0.80 | TSHR (0.50) | TSHRSMN1; SMN2GPBAR1CYSLTR1DRD2 | |
| SCHEMBL6241502 | 0.77 | KDM5A (0.48) | TSHRSMN1; SMN2PPARDGPBAR1CYSLTR1 | |
| SCHEMBL16902898 | 0.77 | KDM5A (0.48) | TSHRSMN1; SMN2PPARDGPBAR1CYSLTR1 | |
| SCHEMBL9859582 | 0.77 | TSHR (0.50) | TSHRSMN1; SMN2GPBAR1CYSLTR1CYP4F2 | |
| SCHEMBL18320474 | 0.75 | ACACB (0.45) | ACACBACACATSHRSMN1; SMN2MAOA | |
| SCHEMBL16902876 | 0.75 | TSHR (0.54) | TSHRSMN1; SMN2GPBAR1CYSLTR1CYP4F2 | |
| SCHEMBL10602833 | 0.75 | TSHR (0.54) | TSHRSMN1; SMN2GPBAR1CYSLTR1CYP4F2 | |
| SCHEMBL18618135 | 0.74 | PPARD (0.48) | PPARDPPARA |
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-1910364-A2 | SPIROPIPERIDINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | Merck & Co., Inc. (US) | 2008-04-16 | — | — | EP | disclosed |
| WO-2007011833-A2 | SPIROPIPERIDINE BETA-SECRETASE INHIBITORS FOR THE TREATMENT OF ALZHEIMER'S DISEASE | MERCK & CO., INC. (US) | 2007-01-25 | — | — | WO | disclosed |