Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.62 |
| ▸ | SCNN1A | P37088 | 8/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.62 |
| ▸ | HPGD | P15428 | 6/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.62 |
| ▸ | GLA | P06280 | 5/20 | 0.62 |
| ▸ | LMNA | P02545 | 4/20 | 0.62 |
| ▸ | PLAU | P00749 | 4/20 | 0.62 |
| ▸ | SLC9A1 | P19634 | 4/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.62 |
| ▸ | GAA | P10253 | 3/20 | 0.62 |
| ▸ | TSHR | P16473 | 3/20 | 0.62 |
| ▸ | FTO | Q9C0B1 | 3/20 | 0.62 |
| ▸ | SLC9A5 | Q14940 | 3/20 | 0.62 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.62 |
| ▸ | BLM | P54132 | 2/20 | 0.62 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.62 |
| ▸ | HTR1A | P08908 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL11528396 | 0.81 | CYP1A2 (0.68) | ALDH1A1SCNN1AKDM4EHPGDHSD17B10 | |
| SCHEMBL11529204 | 0.78 | GRM5 (0.50) | ALDH1A1SCNN1AKDM4EHPGDHSD17B10 | |
| SCHEMBL31325583 | 0.77 | SCNN1A (0.63) | ALDH1A1SCNN1AKDM4EHPGDHSD17B10 | |
| SCHEMBL805324 | 0.77 | SCNN1A (0.63) | ALDH1A1SCNN1AKDM4EHPGDHSD17B10 | |
| Amiloride SCHEMBL27563 | 0.76 | PLAU (1.00) | ALDH1A1SCNN1AKDM4EHPGDHSD17B10 | |
| Amiloride SCHEMBL29531132 | 0.76 | PLAU (1.00) | ALDH1A1SCNN1AKDM4EHPGDHSD17B10 | |
| SCHEMBL29625000 | 0.76 | SCNN1A (0.53) | ALDH1A1SCNN1AKDM4EHPGDHSD17B10 | |
| SCHEMBL1136751 | 0.76 | SCNN1A (0.53) | ALDH1A1SCNN1AKDM4EHPGDHSD17B10 | |
| Amiloride SCHEMBL4155066 | 0.75 | ALDH1A1 (1.00) | ALDH1A1SCNN1AKDM4EHPGDHSD17B10 | |
| Hydrochloric Acid SCHEMBL11496167 | 0.75 | ALDH1A1 (0.65) | ALDH1A1SCNN1AKDM4EHPGDHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-4145551-A | DIURETICS | MERCK & CO., INC. (US) | 1979-03-20 | — | — | US | claimed |
| US-4145551-A | DIURETICS | MERCK & CO., INC. (US) | 1979-03-20 | — | — | US | disclosed |