Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 7/20 | 0.97 |
| ▸ | CA12 | O43570 | 6/20 | 0.97 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.66 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.66 |
| ▸ | CA2 | P00918 | 2/20 | 0.63 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.60 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.60 |
| ▸ | ACHE | P22303 | 2/20 | 0.60 |
| ▸ | ELANE | P08246 | 3/20 | 0.59 |
| ▸ | DRD2 | P14416 | 3/20 | 0.59 |
| ▸ | DRD4 | P21917 | 1/20 | 0.59 |
| ▸ | DRD5 | P21918 | 1/20 | 0.59 |
| ▸ | DRD3 | P35462 | 1/20 | 0.59 |
| ▸ | HTR1A | P08908 | 2/20 | 0.57 |
| ▸ | HTR2A | P28223 | 2/20 | 0.57 |
| ▸ | HTR7 | P34969 | 2/20 | 0.57 |
| ▸ | HTR6 | P50406 | 2/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL1758371 | 0.98 | CA9 (1.00) | CA9CA12ALDH1A1CYP2C19CA2 | |
| SCHEMBL14560535 | 0.97 | CA9 (0.97) | CA9CA12ALDH1A1CYP2C19CA2 | |
| SCHEMBL29621871 | 0.97 | CA9 (0.97) | CA9CA12ALDH1A1CYP2C19CA2 | |
| SCHEMBL7903703 | 0.94 | CA9 (1.00) | CA9CA12ALDH1A1CYP2C19CA2 | |
| SCHEMBL698407 | 0.87 | CA9 (1.00) | CA9CA12ALDH1A1CYP2C19CA2 | |
| SCHEMBL12827008 | 0.86 | CA9 (0.78) | CA9CA12ALDH1A1CYP2C19CA2 | |
| SCHEMBL6324557 | 0.83 | CA9 (0.73) | CA9CA12ALDH1A1CYP2C19CA2 | |
| SCHEMBL17329453 | 0.83 | CA9 (0.73) | CA9CA12CA2HDAC1HDAC2 | |
| SCHEMBL9826952 | 0.83 | CA9 (0.73) | CA9CA12ALDH1A1CYP2C19CA2 | |
| SCHEMBL27183193 | 0.83 | CA9 (0.74) | CA9CA12ALDH1A1CYP2C19CA2 |
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-109776355-A | The preparation method of smooth hypotensor important intermediate 2- cyano-the 4 '-bromomethylbiphenyl of one seed sand | 浙江工业大学 | 2019-05-21 | — | — | CN | disclosed |
| CN-105295747-B | A kind of lubricating type thread locking sealing anaerbic adhesive and preparation method thereof | 湖北回天新材料股份有限公司 | 2017-10-31 | — | — | CN | disclosed |