Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.43 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10767817 | 0.85 | ALDH1A1 (0.43) | PDE3BPDE3AKMT2AADRA2ADRD2 | |
| SCHEMBL10750346 | 0.85 | ADRA2A (0.42) | PDE3BPDE3AKMT2AADRA2ADRD2 | |
| SCHEMBL10956542 | 0.84 | ALDH1A1 (0.53) | KMT2AMEN1ADRA2ADRD2ADRA2B | |
| SCHEMBL10958050 | 0.81 | ADRA2A (0.39) | PDE3BPDE3AKMT2AADRA2ADRD2 | |
| SCHEMBL10957578 | 0.81 | ADORA3 (0.42) | CYP1A2PDE3BPDE3AALDH1A1KDM4E | |
| SCHEMBL10958062 | 0.79 | KDM4E (0.40) | KMT2AADRA2ADRD2ADRA2BDRD3 | |
| SCHEMBL10772349 | 0.77 | HTR7 (0.40) | CYP1A2PDE3BPDE3AKMT2AMEN1 | |
| SCHEMBL10769001 | 0.76 | ADRA2A (0.74) | CYP1A2KMT2AMEN1ADRA2ADRD2 | |
| SCHEMBL10750340 | 0.75 | PDE3B (0.39) | CYP1A2PDE3BPDE3AALDH1A1KDM4E | |
| Bromide SCHEMBL10771783 | 0.75 | ADRA2A (0.73) | CYP1A2KMT2AMEN1ADRA2ADRD2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0176333-A2 | Substituted quinazolinediones | ORTHO PHARMACEUTICAL CORPORATION (US) | 1986-04-02 | — | — | EP | disclosed |