Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 4/20 | 0.40 |
| ▸ | RORC | P51449 | 3/20 | 0.40 |
| ▸ | THRA | P10827 | 1/20 | 0.37 |
| ▸ | AADAT | Q8N5Z0 | 1/20 | 0.37 |
| ▸ | NPBWR1 | P48145 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
| ▸ | GSK3A | P49840 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5325839 | 0.89 | PDE4A (0.37) | CYP3A4THRBTHRAAADATMEN1 | |
| SCHEMBL5326880 | 0.88 | RORC (0.38) | CYP3A4THRBRORCNPBWR1MEN1 | |
| SCHEMBL5333107 | 0.86 | THRB (0.50) | CYP3A4THRBTHRAMEN1KMT2A | |
| SCHEMBL5326116 | 0.83 | THRB (0.39) | CYP3A4THRBRORCTHRANPBWR1 | |
| SCHEMBL5325788 | 0.81 | THRB (0.40) | CYP3A4THRBRORCTHRAAADAT | |
| SCHEMBL5323878 | 0.79 | RORC (0.55) | THRBRORCTHRA | |
| SCHEMBL5329553 | 0.79 | ESRRA (0.39) | THRBRORCTHRANPBWR1MEN1 | |
| SCHEMBL5326865 | 0.78 | RORC (0.46) | THRBRORCTHRANPBWR1MEN1 | |
| SCHEMBL16496798 | 0.77 | CYP1A2 (0.46) | THRBRORCNPBWR1MEN1KMT2A | |
| SCHEMBL5324548 | 0.77 | POLB (0.56) | NPBWR1MEN1KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007132475-A1 | SELECTIVE TR-BETA 1 AGONIST | CADILA HEALTHCARE LIMITED (IN) | 2007-11-22 | — | — | WO | claimed |
| WO-2007132475-A1 | SELECTIVE TR-BETA 1 AGONIST | CADILA HEALTHCARE LIMITED (IN) | 2007-11-22 | — | — | WO | disclosed |