Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 8/20 | 0.72 |
| ▸ | TP53 | P04637 | 1/20 | 0.72 |
| ▸ | THRB | P10828 | 1/20 | 0.72 |
| ▸ | MAPT | P10636 | 6/20 | 0.70 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.69 |
| ▸ | LMNA | P02545 | 2/20 | 0.69 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.65 |
| ▸ | CNR2 | P34972 | 1/20 | 0.64 |
| ▸ | GAA | P10253 | 3/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.63 |
| ▸ | HTT | P42858 | 1/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL8047723 | 0.83 | ALDH1A1 (0.69) | HPGDTP53THRBMAPTNPSR1 | |
| SCHEMBL5440410 | 0.82 | HPGD (0.74) | HPGDTP53THRBMAPTNPSR1 | |
| SCHEMBL5804319 | 0.80 | ALDH1A1 (0.82) | HPGDTP53THRBMAPTNPSR1 | |
| SCHEMBL5804317 | 0.80 | ALDH1A1 (0.82) | HPGDTP53THRBMAPTNPSR1 | |
| SCHEMBL19475109 | 0.79 | HPGD (0.71) | HPGDTP53THRBMAPTNPSR1 | |
| SCHEMBL4417698 | 0.79 | ALDH1A1 (0.80) | HPGDTP53THRBMAPTNPSR1 | |
| SCHEMBL8051335 | 0.78 | ALDH1A1 (0.64) | HPGDTP53THRBMAPTNPSR1 | |
| SCHEMBL17318685 | 0.78 | ALDH1A1 (0.77) | HPGDTP53THRBMAPTNPSR1 | |
| SCHEMBL1579548 | 0.78 | ALDH1A1 (0.72) | HPGDTP53THRBMAPTNPSR1 | |
| SCHEMBL14875905 | 0.78 | ALDH1A1 (0.76) | HPGDTP53THRBMAPTNPSR1 |
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-6166019-A | Piperazinyl pyrimidine dione compounds selective for adrenoceptors | ABBOTT LABORATORIES (US) | 2000-12-26 | — | — | US | disclosed |
| US-6153614-A | Piperazinyl pyrimidine dione compounds selective for adrenoceptors | ABBOTT LABORATORIES (US) | 2000-11-28 | — | — | US | disclosed |