Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 2/20 | 0.38 |
| ▸ | TUBB | P07437 | 2/20 | 0.38 |
| ▸ | TUBA3C | P0DPH7 | 2/20 | 0.38 |
| ▸ | TUBA1B | P68363 | 2/20 | 0.38 |
| ▸ | TUBA4A | P68366 | 2/20 | 0.38 |
| ▸ | TUBB4B | P68371 | 2/20 | 0.38 |
| ▸ | TUBB3 | Q13509 | 2/20 | 0.38 |
| ▸ | TUBB2A | Q13885 | 2/20 | 0.38 |
| ▸ | TUBB8 | Q3ZCM7 | 2/20 | 0.38 |
| ▸ | TUBA3E | Q6PEY2 | 2/20 | 0.38 |
| ▸ | TUBA1A | Q71U36 | 2/20 | 0.38 |
| ▸ | TUBA1C | Q9BQE3 | 2/20 | 0.38 |
| ▸ | TUBB6 | Q9BUF5 | 2/20 | 0.38 |
| ▸ | TUBB2B | Q9BVA1 | 2/20 | 0.38 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8551025 | 0.92 | GAA (0.44) | KDM4EALDH1A1GAAHPGDNPSR1 | |
| SCHEMBL8551848 | 0.86 | CTSV (0.52) | ALDH1A1GAAHPGDTUBB4ATUBB | |
| SCHEMBL8594175 | 0.85 | ALDH1A1 (0.39) | KDM4EALDH1A1GAAHPGDNPSR1 | |
| SCHEMBL8553124 | 0.84 | GABRA1 (0.43) | KDM4EALDH1A1HPGDTUBB4ATUBB | |
| SCHEMBL8546754 | 0.83 | NPC1 (0.40) | KDM4EALDH1A1GAAHPGDNPSR1 | |
| SCHEMBL8552296 | 0.83 | PDE4B (0.42) | KDM4EALDH1A1HPGDPDE4B | |
| SCHEMBL8549511 | 0.82 | KDM4E (0.40) | KDM4EALDH1A1GAAHPGDTUBB4A | |
| SCHEMBL8552525 | 0.78 | ELANE (0.38) | KDM4EALDH1A1GAAHPGDNPSR1 | |
| SCHEMBL8547179 | 0.77 | GABRA1 (0.45) | KDM4EALDH1A1HPGDTUBB4ATUBB | |
| SCHEMBL8546850 | 0.76 | KDM4E (0.52) | KDM4EALDH1A1GAAHPGDNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0863898-A1 | ENDOTHELIN RECEPTOR ANTAGONISTS | MERCK PATENT GmbH (DE) | 1998-09-16 | — | — | EP | disclosed |
| WO-1997019077-A1 | ENDOTHELIN RECEPTOR ANTAGONISTS | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1997-05-29 | — | — | WO | disclosed |