Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 2/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.46 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.46 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.46 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.46 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | ELANE | P08246 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28970715 | 0.98 | CYP2C19 (0.51) | CYP2C19CA1CA2CA9CA12 | |
| SCHEMBL21084970 | 0.76 | CYP2C19 (0.54) | CYP2C19NPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL14172627 | 0.75 | CA1 (0.37) | CA1CA2CA9CA12GABRA1 | |
| SCHEMBL13179763 | 0.75 | CYP2C19 (0.57) | CYP2C19NPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL17506045 | 0.75 | CYP2C19 (0.53) | CYP2C19NPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL14894920 | 0.74 | CDC25B (0.48) | CYP2C19CA1CA2CA9NPC1 | |
| SCHEMBL29420730 | 0.74 | CDC25B (0.48) | CYP2C19CA1CA2CA9NPC1 | |
| SCHEMBL13668026 | 0.73 | CYP2C19 (0.56) | CYP2C19NPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL10617594 | 0.73 | CYP2C19 (0.51) | CYP2C19NPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL10617590 | 0.73 | CYP2C19 (0.51) | CYP2C19NPC1ALDH1A1RAB9ASMN1; SMN2 |
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-1006386-B | PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER | SHINETSU CHEM IND CO (JP) | 1990-01-10 | — | — | CN | disclosed |
| CN-85107531-A | Process for producing vinyl chloride polymer | — | 1987-01-21 | — | — | CN | disclosed |