Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 7/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 7/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL7839101 | 0.93 | PDE4D (0.42) | KDM4EHSD17B10GAANPC1RAB9A | |
| SCHEMBL7840763 | 0.90 | TAS1R3 (0.41) | TAS1R3TAS1R1KDM4EHSD17B10GAA | |
| SCHEMBL7841575 | 0.90 | HTT (0.40) | TAS1R3TAS1R1KDM4EHSD17B10GAA | |
| SCHEMBL7842205 | 0.89 | KDM4E (0.43) | KDM4EHSD17B10GAANPC1RAB9A | |
| SCHEMBL7842210 | 0.87 | KDM4E (0.46) | KDM4EHSD17B10GAANPC1RAB9A | |
| SCHEMBL7842966 | 0.86 | MAPT (0.47) | KDM4EHSD17B10GAANPC1RAB9A | |
| SCHEMBL7838632 | 0.85 | L3MBTL1 (0.49) | KDM4EHSD17B10GAANPC1RAB9A | |
| SCHEMBL7838638 | 0.84 | NPC1 (0.47) | KDM4EHSD17B10GAANPC1RAB9A | |
| SCHEMBL7840463 | 0.83 | KDM4E (0.44) | KDM4EHSD17B10GAANPC1RAB9A | |
| SCHEMBL7840868 | 0.83 | KMT2A (0.54) | KDM4EHSD17B10GAANPC1RAB9A |
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-0882030-B1 | 2,1,3-BENZOTHIA(OXA)DIAZOLE DERIVATIVES HAVING AN ENDOTHELIN RECEPTOR ANTAGONISTIC EFFECT | MERCK PATENT GMBH (DE) | 2001-09-12 | — | — | EP | disclosed |
| US-6017939-A | 2,1,3-benzothia(OXA)diazole derivatives having an endothelin receptor antagonistic effect | MERCK PATENT GESELLSCHAFT (DE) | 2000-01-25 | — | — | US | disclosed |