Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.35 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | EDNRB | P24530 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL7573385 | 0.90 | EDNRA (0.36) | CYP2C9EDNRBALDH1A1PTGER1GAA | |
| SCHEMBL7570877 | 0.84 | EDNRB (0.46) | CYP2C9EDNRBALDH1A1POLBPTGER1 | |
| SCHEMBL7570355 | 0.81 | EDNRB (0.49) | CYP2C9NPC1RAB9AEDNRBALDH1A1 | |
| SCHEMBL7573991 | 0.81 | NPC1 (0.41) | NPC1RAB9AALDH1A1POLBGAA | |
| SCHEMBL7565514 | 0.80 | HPGD (0.39) | NPC1RAB9AALDH1A1POLBMEN1 | |
| SCHEMBL7568959 | 0.79 | EDNRB (0.47) | EDNRB | |
| SCHEMBL7574315 | 0.78 | EDNRB (0.59) | CYP2C9EDNRBALDH1A1GAAMEN1 | |
| SCHEMBL7568975 | 0.75 | EDNRA (0.47) | CYP2C9EDNRBALDH1A1LMNA | |
| SCHEMBL7566550 | 0.74 | EDNRB (0.60) | CYP2C9NPC1RAB9AEDNRBALDH1A1 | |
| SCHEMBL7565796 | 0.72 | EDNRA (0.47) | CYP2C9NPC1EDNRBALDH1A1GAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0799206-B1 | ARYL- AND HETARYL-SULFONAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS ENDOTHELIN ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2002-09-11 | — | — | EP | disclosed |
| EP-0799206-A1 | ARYL- AND HETARYL-SULFONAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS ENDOTHELIN ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 1997-10-08 | — | — | EP | disclosed |
| WO-1996019455-A1 | ARYL- AND HETARYL-SULFONAMIDE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS ENDOTHELIN ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 1996-06-27 | — | — | WO | disclosed |