Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC5A2 | P31639 | 2/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.42 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.37 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.35 |
| ▸ | CD74 | P04233 | 1/20 | 0.33 |
| ▸ | MIF | P14174 | 1/20 | 0.33 |
| ▸ | IDH1 | O75874 | 1/20 | 0.33 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.33 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6405784 | 1.00 | SLC5A2 (0.42) | SLC5A2TRPA1LPAR1CPB2CD74 | |
| SCHEMBL6407470 | 0.77 | LMNA (0.47) | SLC5A2ALDH1A1LMNAMAPK1HTT | |
| SCHEMBL6404491 | 0.77 | LMNA (0.47) | SLC5A2ALDH1A1LMNAMAPK1HTT | |
| SCHEMBL6616678 | 0.74 | TLR8 (0.33) | TRPA1CD74MIFALDH1A1KCNMA1 | |
| SCHEMBL30741761 | 0.74 | HPGDS (0.50) | CPB2KCNH2ALDH1A1KCNMA1MAPT | |
| SCHEMBL6182324 | 0.70 | LTA4H (0.40) | CPB2KCNMA1LTA4HTSHR | |
| SCHEMBL6952807 | 0.68 | SIGMAR1 (0.45) | ALDH1A1KCNMA1MAPK1HTTMAPT | |
| SCHEMBL6402795 | 0.67 | LMNA (0.44) | KCNH2ALDH1A1LMNAMAPK1HTT | |
| SCHEMBL1691046 | 0.66 | GRN (0.47) | CPB2MAPT | |
| SCHEMBL5018774 | 0.66 | HPGDS (0.46) | CPB2MAPT |
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-1411933-A1 | ALPHA-KETOAMIDE DERIVATIVES AS CATHEPSIN K INHIBITORS | SmithKline Beecham Corporation (US) | 2004-04-28 | — | — | EP | disclosed |
| WO-2003013518-A1 | ALPHA-KETOAMIDE DERIVATIVES AS CATHEPSIN K INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2003-02-20 | — | — | WO | disclosed |