Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD3 | P35462 | 11/20 | 0.33 |
| ▸ | DRD2 | P14416 | 8/20 | 0.33 |
| ▸ | DRD1 | P21728 | 7/20 | 0.33 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.31 |
| ▸ | DRD4 | P21917 | 1/20 | 0.31 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 2/20 | 0.31 |
| ▸ | HTR2A | P28223 | 2/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6996046 | 0.95 | KDM4E (0.33) | DRD3DRD2DRD1DRD4GRM5 | |
| SCHEMBL6774144 | 0.88 | DRD3 (0.36) | DRD3DRD2DRD1DRD4GRM5 | |
| SCHEMBL6997801 | 0.85 | DRD3 (0.32) | DRD3DRD2DRD1DRD4GRM5 | |
| SCHEMBL6621027 | 0.84 | DRD3 (0.34) | DRD3DRD2DRD1DRD4GRM5 | |
| SCHEMBL9040855 | 0.83 | PTPN1 (0.39) | DRD3DRD2DRD1PLA2G2AGRM5 | |
| SCHEMBL9041335 | 0.81 | PTPN1 (0.37) | GRM5KDM4ENPC1ALDH1A1HPGD | |
| SCHEMBL6992176 | 0.81 | TBXAS1 (0.43) | — | |
| SCHEMBL6994951 | 0.81 | PTPN1 (0.36) | DRD3DRD2DRD1DRD4GRM5 | |
| SCHEMBL9040322 | 0.80 | PTPN1 (0.35) | KDM4EALDH1A1HPGDMEN1MAPT | |
| SCHEMBL6997471 | 0.79 | KDM4E (0.31) | KDM4EALDH1A1HPGDMEN1MAPT |
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-0557526-B1 | PYRROLOAZEPINE COMPOUND | SUNTORY LTD (JP) | 2003-04-02 | — | — | EP | disclosed |
| US-5399557-A | Cardiovascular disorders | SUNTORY LIMITED (JP) | 1995-03-21 | — | — | US | disclosed |
| EP-0557526-A1 | PYRROLOAZEPINE COMPOUND | SUNTORY LIMITED (JP) | 1993-09-01 | — | — | EP | disclosed |