Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.62 |
| ▸ | TNKS | O95271 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 4/20 | 0.36 |
| ▸ | MAOB | P27338 | 4/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | C5AR1 | P21730 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16696119 | 0.92 | CYP3A4 (0.49) | CYP3A4NPSR1TSHRCRHBPCRHR2 | |
| SCHEMBL16696145 | 0.89 | CYP3A4 (0.53) | CYP3A4TNKSCYP2D6C5AR1 | |
| SCHEMBL16696055 | 0.88 | CYP3A4 (0.80) | CYP3A4TNKSMAOAMAOBCYP2D6 | |
| SCHEMBL16696101 | 0.87 | CYP3A4 (0.61) | CYP3A4TNKSCYP2D6NPSR1TSHR | |
| SCHEMBL9940498 | 0.87 | CYP3A4 (0.60) | CYP3A4TNKSCYP2D6C5AR1 | |
| SCHEMBL16696165 | 0.85 | CYP3A4 (0.61) | CYP3A4TNKSCYP2D6NPSR1TSHR | |
| SCHEMBL16696129 | 0.85 | CYP3A4 (0.61) | CYP3A4TNKSMAOAMAOBCYP2D6 | |
| SCHEMBL16696088 | 0.84 | CYP3A4 (0.59) | CYP3A4TNKSCYP2D6TSHRC5AR1 | |
| SCHEMBL16696054 | 0.84 | CYP3A4 (0.47) | CYP3A4CYP2D6C5AR1 | |
| SCHEMBL16696158 | 0.83 | CYP3A4 (0.56) | CYP3A4TNKSCYP2D6NPSR1TSHR |
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-2015065336-A1 | RESPIRATORY SYNCYTIAL VIRUS INHIBITORS | MEDIVIR AB (SE) | 2015-05-07 | — | — | WO | disclosed |