Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.38 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | PRNP | P04156 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.35 |
| ▸ | AHR | P35869 | 2/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | NQO2 | P16083 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11525331 | 0.88 | CYP3A4 (0.39) | TDP1CYP3A4TSHRGABRA1GABRB1 | |
| SCHEMBL31540581 | 0.85 | CYP2A6 (0.50) | TDP1CYP3A4TSHRNPSR1HPGD | |
| SCHEMBL6754533 | 0.83 | CYP2A6 (0.48) | TDP1CYP3A4TSHRNPSR1HPGD | |
| SCHEMBL28253602 | 0.80 | CYP2A6 (0.44) | TDP1CYP3A4TSHRLMNAHPGD | |
| SCHEMBL8556469 | 0.78 | CYP2A6 (0.48) | TDP1CYP3A4TSHRLMNAHPGD | |
| SCHEMBL30449010 | 0.76 | TDP1 (0.50) | TDP1CYP3A4TSHRGABRA1GABRB1 | |
| SCHEMBL4324429 | 0.76 | TDP1 (0.50) | TDP1CYP3A4TSHRGABRA1GABRB1 | |
| SCHEMBL21546553 | 0.73 | CYP2A6 (0.33) | TDP1CYP3A4TSHRRXFP1ALDH1A1 | |
| SCHEMBL29524488 | 0.73 | CYP2A6 (0.48) | TDP1CYP3A4TSHRHPGDRXFP1 | |
| SCHEMBL3103031 | 0.73 | CYP2A6 (0.48) | TDP1CYP3A4TSHRHPGDRXFP1 |
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 |