Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ECE1 | P42892 | 17/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.40 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.40 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.40 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.40 |
| ▸ | RORC | P51449 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8363443 | 0.88 | ECE1 (0.81) | ECE1KCNQ3KCNQ2KCNQ4KCNQ5 | |
| SCHEMBL6002242 | 0.81 | ECE1 (0.47) | ECE1ALDH1A1RORC | |
| SCHEMBL6019060 | 0.77 | ECE1 (0.74) | ECE1 | |
| SCHEMBL8363856 | 0.76 | ECE1 (0.49) | ECE1KCNQ3KCNQ2KCNQ4KCNQ5 | |
| SCHEMBL6019583 | 0.76 | ECE1 (0.73) | ECE1ALDH1A1 | |
| SCHEMBL6019258 | 0.76 | ECE1 (0.75) | ECE1 | |
| SCHEMBL16473015 | 0.75 | NOD2 (0.55) | ALDH1A1 | |
| SCHEMBL28305009 | 0.72 | NOD2 (0.66) | ALDH1A1 | |
| SCHEMBL2433031 | 0.70 | AR (0.51) | ALDH1A1 | |
| SCHEMBL16747379 | 0.70 | F11 (0.40) | ECE1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004056768-A2 | USE OF SUBSTITUTED 2,5-DIAMIDOINDOLES FOR THE TREATMENT OF UROLOGICAL DISEASES | BAYER HEALTHCARE AG (DE) | 2004-07-08 | — | — | WO | disclosed |
| WO-2003028719-A1 | SUBSTITUTED 2,5-DIAMIDOINDOLES AS ECE INHIBITORS FOR THE TREATMENT OF CARDIOVASCULAR DISEASES | BAYER HEALTHCARE AG (DE) | 2003-04-10 | — | — | WO | disclosed |