Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.58 |
| ▸ | NCF1 | P14598 | 5/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | GLA | P06280 | 3/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | CASP1 | P29466 | 2/20 | 0.45 |
| ▸ | CASP7 | P55210 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | NQO2 | P16083 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | DRD1 | P21728 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8912375 | 0.96 | ACHE (0.58) | ACHENCF1KDM4EALDH1A1GLA | |
| SCHEMBL8908598 | 0.95 | ACHE (0.56) | ACHENCF1KDM4EALDH1A1GLA | |
| SCHEMBL8907361 | 0.95 | ACHE (0.56) | ACHENCF1KDM4EALDH1A1GLA | |
| SCHEMBL8908674 | 0.95 | ACHE (0.56) | ACHENCF1KDM4EALDH1A1GLA | |
| SCHEMBL8907350 | 0.95 | ACHE (0.56) | ACHENCF1KDM4EALDH1A1GLA | |
| Water SCHEMBL5569079 | 0.93 | ACHE (0.54) | ACHENCF1KDM4EALDH1A1GLA | |
| Hydrochloric Acid SCHEMBL10611760 | 0.93 | ACHE (0.54) | ACHENCF1KDM4EALDH1A1GLA | |
| SCHEMBL28014894 | 0.90 | NCF1 (0.53) | ACHENCF1KDM4EALDH1A1HPGD | |
| SCHEMBL23044015 | 0.89 | TLR8 (0.52) | ACHENCF1KDM4EALDH1A1GLA | |
| SCHEMBL28514975 | 0.87 | TLR8 (0.53) | ACHENCF1KDM4EALDH1A1GLA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1997048705-A1 | POTASSIUM CHANNEL BLOCKERS | UNIVERSITY COLLEGE LONDON (GB) | 1997-12-24 | — | — | WO | disclosed |