Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10990387 | 0.80 | NPSR1 (0.45) | NPSR1 | |
| SCHEMBL10694310 | 0.79 | HDAC3 (0.43) | CYP1A2CYP2D6KCNN4HDAC3HDAC4 | |
| SCHEMBL10694507 | 0.77 | CNR1 (0.40) | KCNN4HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL2905973 | 0.77 | CYP1A2 (0.46) | CYP1A2CYP2D6KCNN4HDAC3HDAC4 | |
| SCHEMBL11061722 | 0.75 | KCNN4 (0.42) | CYP1A2CYP2D6KCNN4HDAC3HDAC4 | |
| SCHEMBL10691473 | 0.75 | RIPK1 (0.53) | GAA | |
| SCHEMBL10692938 | 0.74 | LMNA (0.51) | CYP1A2CYP2D6NPSR1HDAC3HDAC4 | |
| SCHEMBL27405464 | 0.74 | MAPT (0.52) | CYP1A2CYP2D6NPSR1KCNN4HDAC3 | |
| SCHEMBL10693506 | 0.74 | MAPT (0.52) | CYP1A2CYP2D6KCNN4HDAC3HDAC4 | |
| SCHEMBL28625693 | 0.74 | HDAC3 (0.63) | CYP1A2CYP2D6NPSR1KCNN4HDAC3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0098743-B1 | PHENYL ALPHA-ACYLOXYACETAMIDE DERIVATES AND THEIR THERAPEUTIC USE | Yu, Ruey J., Dr. (US) | 1988-09-28 | — | — | EP | claimed |
| US-4518789-A | Phenyl alpha-acyloxyacetamide derivatives and their therapeutic use | YU RUEY J | 1985-05-21 | — | — | US | disclosed |
| EP-0098743-A1 | Phenyl alpha-acyloxyacetamide derivates and their therapeutic use | Yu, Ruey J., Dr. (US) | 1984-01-18 | — | — | EP | disclosed |