Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RGS4 | P49798 | 2/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.51 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.51 |
| ▸ | APBA1 | Q02410 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.51 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.51 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.51 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.51 |
| ▸ | MGLL | Q99685 | 2/20 | 0.50 |
| ▸ | FAAH | O00519 | 1/20 | 0.50 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.48 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | BCHE | P06276 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL9171007 | 0.90 | RGS4 (0.79) | RGS4ALDH1A1NPSR1MAPTHPGD | |
| SCHEMBL28976692 | 0.86 | RGS4 (0.65) | RGS4ALDH1A1NPSR1MAPTHPGD | |
| SCHEMBL28976672 | 0.83 | RGS4 (0.65) | RGS4ALDH1A1NPSR1MAPTHPGD | |
| SCHEMBL28976684 | 0.82 | RGS4 (0.60) | RGS4ALDH1A1NPSR1MAPTHPGD | |
| SCHEMBL2644212 | 0.82 | RGS4 (0.64) | RGS4MAPTNR1H2NR1H3GSK3A | |
| SCHEMBL13517162 | 0.80 | RGS4 (1.00) | RGS4ALDH1A1NPSR1MAPTHPGD | |
| SCHEMBL28976859 | 0.79 | RGS4 (0.56) | RGS4ALDH1A1MAPTLMNATP53 | |
| SCHEMBL7861858 | 0.79 | RGS4 (0.59) | RGS4ALDH1A1NPSR1MAPTHPGD | |
| SCHEMBL30272716 | 0.78 | RGS4 (0.55) | RGS4ALDH1A1MAPTALOX12LMNA | |
| SCHEMBL7774092 | 0.78 | RGS4 (0.58) | RGS4ALDH1A1NPSR1MAPTHPGD |
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-107162950-A | N substitution maleimide compounds and its preparation based on pharmaceutical intermediate are studied with antibacterial activity | 浙江工业大学 | 2017-09-15 | — | — | CN | disclosed |