Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | PRKAB2 | O43741 | 4/20 | 0.32 |
| ▸ | PRKAG1 | P54619 | 4/20 | 0.32 |
| ▸ | PRKAA2 | P54646 | 4/20 | 0.32 |
| ▸ | PRKAA1 | Q13131 | 4/20 | 0.32 |
| ▸ | PRKAG3 | Q9UGI9 | 4/20 | 0.32 |
| ▸ | PRKAG2 | Q9UGJ0 | 4/20 | 0.32 |
| ▸ | PRKAB1 | Q9Y478 | 4/20 | 0.32 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL27552358 | 0.83 | MTNR1A (0.39) | MTNR1AMTNR1BPRKAB2PRKAG1PRKAA2 | |
| SCHEMBL27648729 | 0.81 | MTNR1A (0.41) | MTNR1AMTNR1BPRKAB2PRKAG1PRKAA2 | |
| SCHEMBL27942878 | 0.78 | GPR84 (0.47) | MTNR1AMTNR1BPRKAB2PRKAG1PRKAA2 | |
| SCHEMBL27768300 | 0.77 | MTNR1A (0.40) | MTNR1AMTNR1BPRKAB2PRKAG1PRKAA2 | |
| SCHEMBL27550865 | 0.73 | NR4A2 (0.46) | PDE4D | |
| SCHEMBL28038344 | 0.72 | MTNR1A (0.33) | MTNR1AMTNR1B | |
| SCHEMBL27438636 | 0.72 | LMNA (0.38) | MTNR1AMTNR1BPDE4APDE4BPDE4C | |
| SCHEMBL27768537 | 0.72 | THRA (0.32) | MTNR1AMTNR1B | |
| SCHEMBL27526971 | 0.71 | NR4A2 (0.44) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL16122568 | 0.71 | ATM (0.45) | PDE4APDE4BPDE4CPDE4DPRKAB2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100418968-C | Pirazino(aza)indole derivatives | VERNALIS RES LTD (GB) | 2008-09-17 | — | — | CN | disclosed |
| CN-1289499-C | Pyrazino (aza) indole derivatives | VERNALIS RES LTD (GB) | 2006-12-13 | — | — | CN | disclosed |
| CN-1837207-A | Pirazino(aza)indole derivatives | VERNALIS RES LTD (GB) | 2006-09-27 | — | — | CN | disclosed |
| CN-1337963-A | Pyrazino (aza) indole derivatives | VERNALIS RES LTD (GB) | 2002-02-27 | — | — | CN | disclosed |