Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.43 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | NPY5R | Q15761 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 4/20 | 0.36 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | TDP2 | O95551 | 1/20 | 0.35 |
| ▸ | KMO | O15229 | 1/20 | 0.35 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28856074 | 1.00 | SMPD3 (0.43) | SMPD3NISCHPTGS2PTGS1NPY5R | |
| SCHEMBL25220187 | 0.75 | SMPD3 (0.49) | SMPD3NPY5RALDH1A1MAPTHPGD | |
| SCHEMBL30050369 | 0.70 | SOS1 (0.43) | NISCHPTGS2PTGS1ALDH1A1MAPT | |
| SCHEMBL15948070 | 0.70 | SOS1 (0.43) | NISCHPTGS2PTGS1ALDH1A1MAPT | |
| SCHEMBL14153754 | 0.69 | KMT2A (0.54) | SMPD3NPY5RALDH1A1MAPTKMT2A | |
| SCHEMBL14153752 | 0.69 | SMPD3 (0.49) | SMPD3NPY5RALDH1A1MAPTHPGD | |
| SCHEMBL15516726 | 0.69 | PTGS2 (0.51) | NISCHPTGS2PTGS1PGRTDP2 | |
| SCHEMBL6861541 | 0.68 | KMT2A (0.57) | SMPD3NPY5RALDH1A1MAPTKMT2A | |
| SCHEMBL22955324 | 0.68 | KDM4E (0.48) | ALDH1A1MAPTHPGDHTTCACNA1B | |
| SCHEMBL22408471 | 0.67 | ALDH1A1 (0.49) | SMPD3NPY5RALDH1A1HPGDL3MBTL1 |
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-114989173-B | Imidazole compound, pharmaceutical composition and application thereof | 广州市恒诺康医药科技有限公司 | 2024-03-19 | — | — | CN | disclosed |
| CN-114989173-A | Imidazole compound, pharmaceutical composition and application thereof | 广州市恒诺康医药科技有限公司 | 2022-09-02 | — | — | CN | disclosed |