Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2721346 | 0.79 | ALDH1A1 (0.64) | ALDH1A1NPSR1NOTUMKMT2ATSHR | |
| SCHEMBL12615992 | 0.78 | ALDH1A1 (0.68) | ALDH1A1NPSR1NOTUMKMT2ATSHR | |
| SCHEMBL4203255 | 0.75 | ALDH1A1 (0.49) | ALDH1A1NPSR1NOTUMKMT2ATSHR | |
| SCHEMBL4202205 | 0.75 | ALDH1A1 (0.51) | ALDH1A1NPSR1TSHRKDM4E | |
| SCHEMBL5607411 | 0.73 | KMT2A (0.56) | ALDH1A1NPSR1KMT2ATSHRHTR1A | |
| SCHEMBL4207326 | 0.72 | ALDH1A1 (0.45) | ALDH1A1NPSR1NOTUMKMT2ATSHR | |
| SCHEMBL2796621 | 0.70 | ALDH1A1 (1.00) | ALDH1A1NPSR1NOTUMKMT2ATSHR | |
| SCHEMBL28955008 | 0.69 | ALDH1A1 (0.58) | ALDH1A1NPSR1NOTUMKMT2ATSHR | |
| SCHEMBL5330184 | 0.69 | ALDH1A1 (0.58) | ALDH1A1NPSR1NOTUMKMT2ATSHR | |
| SCHEMBL30084182 | 0.69 | ALDH1A1 (0.58) | ALDH1A1NPSR1NOTUMKMT2ATSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-103373969-B | Phenyl azoles ring substituted amide compounds and its production and use | SHANGHAI INSTITUTE OF ORGANIC CHEMISTRY, CHINESE ACADEMY OF SCIENCES (CN) | 2015-09-16 | — | — | CN | disclosed |
| CN-103373969-A | Phenyl imidazole ring-substituted amide compounds as well as preparation method and application for same | SHANGHAI INST ORGANIC CHEM | 2013-10-30 | — | — | CN | disclosed |