Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 5/20 | 0.44 |
| ▸ | PDE3A | Q14432 | 5/20 | 0.44 |
| ▸ | SYK | P43405 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.31 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | IDH1 | O75874 | 3/20 | 0.31 |
| ▸ | F10 | P00742 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.31 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL22308888 | 0.89 | PDE3B (0.56) | PDE3BPDE3A | |
| SCHEMBL20703432 | 0.81 | PDE3B (0.45) | PDE3BPDE3ACYP1A2CYP3A4CYP2C9 | |
| SCHEMBL22304515 | 0.80 | PDE3B (0.46) | PDE3BPDE3ANR3C2NR3C1PGR | |
| SCHEMBL22309145 | 0.74 | PDE3B (0.42) | PDE3BPDE3APGR | |
| SCHEMBL22309155 | 0.74 | PDE3B (0.47) | PDE3BPDE3A | |
| SCHEMBL22308892 | 0.73 | PDE3B (0.62) | PDE3BPDE3ANPC1RAB9AHTT | |
| SCHEMBL22309151 | 0.73 | PDE3B (0.48) | PDE3BPDE3ANPC1RAB9A | |
| SCHEMBL22308851 | 0.71 | PDE3B (0.54) | PDE3BPDE3AMAPTNPSR1 | |
| SCHEMBL22289023 | 0.71 | PDE3B (0.41) | PDE3BPDE3ASYKSCN9ANR3C2 | |
| SCHEMBL4196668 | 0.69 | PARP1 (0.43) | PDE3BPDE3A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020157189-A1 | 1,2,4-TRIAZIN-6(1H)-ONE COMPOUNDS FOR THE TREATMENT OF HYPERPROLIFERATIVE DISEASES | BAYER AKTIENGESELLSCHAFT (DE) | 2020-08-06 | — | — | WO | disclosed |