Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.63 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HTR1A | P08908 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | HTR7 | P34969 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.49 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11644120 | 0.95 | CYP2D6 (0.70) | HSD17B10CYP2D6MAPTNPSR1KCNH2 | |
| SCHEMBL4403559 | 0.88 | MAPT (0.61) | HSD17B10CYP2D6MAPTNPSR1KCNH2 | |
| SCHEMBL13321082 | 0.85 | KDM4E (0.71) | MAPTNPSR1KCNH2KDM4EGAA | |
| SCHEMBL3200018 | 0.83 | KDM4E (0.69) | HSD17B10CYP2D6KCNH2KDM4EGAA | |
| SCHEMBL3197906 | 0.83 | CYP2D6 (0.63) | HSD17B10CYP2D6MAPTKCNH2ALDH1A1 | |
| SCHEMBL3197073 | 0.83 | CYP2D6 (0.63) | HSD17B10CYP2D6MAPTKCNH2KDM4E | |
| SCHEMBL5185951 | 0.83 | CYP2D6 (0.63) | HSD17B10CYP2D6KCNH2KDM4EGAA | |
| SCHEMBL3025110 | 0.83 | CYP2D6 (0.90) | HSD17B10CYP2D6KCNH2HTR1AHTR7 | |
| SCHEMBL3189235 | 0.83 | HSD17B10 (0.55) | HSD17B10CYP2D6KCNH2KDM4EGAA | |
| SCHEMBL3186225 | 0.83 | HSD17B10 (0.91) | HSD17B10CYP2D6KCNH2HTR1AMEN1 |
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-4452798-A | 1-Substituted phenyl-4-alkyl hydantoin piperazine compounds as antihypertensive agents | WARNER-LAMBERT COMPANY (US) | 1984-06-05 | — | — | US | disclosed |
| EP-0103357-A2 | Substituted phenylpiperazine compounds suitable as antihypertensive agents, and processes for their production | WARNER-LAMBERT COMPANY (US) | 1984-03-21 | — | — | EP | disclosed |