Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNF | P01375 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.32 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.32 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20439359 | 1.00 | TNF (0.34) | TNFMAPTGAAHPGDHDAC1 | |
| SCHEMBL20439327 | 0.81 | GPR88 (0.40) | MAPTEPHX2 | |
| SCHEMBL20439375 | 0.77 | DHFR (0.37) | HPGDPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL20439360 | 0.77 | DHFR (0.37) | HPGDPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL20439361 | 0.77 | SLC6A3 (0.40) | EPHX2 | |
| SCHEMBL30057152 | 0.74 | ITGB1 (0.47) | — | |
| SCHEMBL21838242 | 0.74 | ITGB1 (0.47) | — | |
| SCHEMBL21838241 | 0.74 | ITGB1 (0.47) | — | |
| SCHEMBL20425125 | 0.72 | DHFR (0.37) | HPGDPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7925815 | 0.72 | TNF (0.46) | TNFHDAC1HDAC2 |
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-2018138739-A1 | NOVEL ANTIESTROGENIC HETEROCYCLIC COMPOUNDS | SUN PHARMA ADVANCED RESEARCH COMPANY LIMITED (IN) | 2018-08-02 | — | — | WO | disclosed |