Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | PRNP | P04156 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | GRK6 | P43250 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.33 |
| ▸ | EIF4E | P06730 | 1/20 | 0.33 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28077207 | 0.87 | ALDH1A1 (0.46) | ALDH1A1KDM4ESMN1; SMN2GAAMEN1 | |
| SCHEMBL3038641 | 0.72 | CES2 (0.46) | SLC9A1NPC1GRK6BCAT1CES2 | |
| SCHEMBL28077415 | 0.71 | TRPM8 (0.50) | ALDH1A1KDM4ESMN1; SMN2GAAMEN1 | |
| SCHEMBL9628660 | 0.70 | APEX1 (0.48) | — | |
| SCHEMBL28077397 | 0.70 | GRM2 (0.37) | KDM4ESMN1; SMN2HPGDALOX5MAPT | |
| SCHEMBL13071549 | 0.69 | GAA (0.53) | ALDH1A1KDM4ESMN1; SMN2GAAMEN1 | |
| SCHEMBL28077371 | 0.69 | TRPM8 (0.64) | KDM4ETRPM8 | |
| SCHEMBL14832981 | 0.69 | ALB (0.43) | SLC9A1GRK6BCAT1CES2BCHE | |
| SCHEMBL6367917 | 0.67 | ALDH1A1 (0.44) | ALDH1A1KDM4ESMN1; SMN2MEN1NPC1 | |
| SCHEMBL28077209 | 0.67 | ALOX5 (0.62) | ALOX5TRPM8 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104334544-B | Benzimidazole proline derivative | 埃科特莱茵药品有限公司 | 2016-10-19 | — | — | CN | disclosed |