Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 1/20 | 0.44 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.43 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.43 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.43 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.39 |
| ▸ | EDNRA | P25101 | 1/20 | 0.39 |
| ▸ | PTPRC | P08575 | 1/20 | 0.39 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.38 |
| ▸ | TDO2 | P48775 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TMIGD3 | P0DMS9 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6320052 | 0.83 | CYP2A6 (0.52) | CYP2A6CYP2B6CYP2E1GPR35CYP3A4 | |
| SCHEMBL1132878 | 0.81 | CYP2A6 (0.45) | PDCD1CD274CYP2A6CYP2B6CYP2E1 | |
| SCHEMBL13824218 | 0.77 | CD274 (0.64) | PDCD1CD274CYP2A6CYP2B6CYP2E1 | |
| SCHEMBL26259994 | 0.76 | CYP2A6 (0.52) | CYP2A6CYP2B6CYP2E1CYP3A4CYP2C9 | |
| SCHEMBL2205351 | 0.75 | CYP2A6 (0.36) | PDCD1CD274CYP2A6CYP2B6CYP2E1 | |
| SCHEMBL4946960 | 0.75 | CYP2A6 (0.64) | CYP2A6CYP2B6CYP2E1CYP3A4CYP2C9 | |
| SCHEMBL3692592 | 0.75 | TRPA1 (0.46) | PDCD1CD274CYP2A6SMN1; SMN2 | |
| SCHEMBL31110225 | 0.73 | TRPA1 (0.44) | PDCD1CD274CYP2A6SMN1; SMN2 | |
| SCHEMBL27467614 | 0.73 | CYP2A6 (0.39) | PDCD1CD274CYP2A6CYP2B6CYP2E1 | |
| SCHEMBL21848864 | 0.72 | CYP2A6 (0.59) | CYP2A6CYP2B6CYP2E1GPR35CYP3A4 |
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-1130355-C | Thienyl-, Furyl-, Pyrrolyl- and biphenylsulfonamides and derivatives thereof that modulate the activity of endothelin | TEXAS BIOTECHNOLOGY CORP (US) | 2003-12-10 | — | — | CN | disclosed |
| CN-1184470-A | Thienyl-, Furyl-, Pyrrolyl- and biphenylsulfonamides and derivatives thereof that modulate the activity of endothelin | TEXAS BIOTECHNOLOGY CORP (US) | 1998-06-10 | — | — | CN | disclosed |