Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 1/20 | 0.39 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 9/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 4/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | NR3C2 | P08235 | 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 | |
|---|---|---|---|---|
| SCHEMBL9300523 | 0.86 | PDE4A (0.38) | PDE4APDE4BPDE4CPDE4DCYP3A4 | |
| SCHEMBL9300169 | 0.85 | PDE4A (0.39) | PDE4APDE4BPDE4CPDE4DCYP3A4 | |
| SCHEMBL9299519 | 0.82 | PDE4A (0.41) | PDE4APDE4BPDE4CPDE4DCYP3A4 | |
| SCHEMBL9299446 | 0.82 | PDE4A (0.38) | PDE4APDE4BPDE4CPDE4DCYP3A4 | |
| SCHEMBL9299270 | 0.81 | PDE4A (0.44) | PDE4APDE4BPDE4CPDE4DABCB1 | |
| SCHEMBL9300253 | 0.81 | PDE4A (0.40) | PDE4APDE4BPDE4CPDE4DABCB1 | |
| SCHEMBL9300535 | 0.81 | PDE4A (0.40) | PDE4APDE4BPDE4CPDE4DABCB1 | |
| SCHEMBL9300381 | 0.79 | PDE4A (0.39) | PDE4APDE4BPDE4CPDE4DCYP3A4 | |
| SCHEMBL9596470 | 0.79 | PDE4A (0.41) | PDE4APDE4BPDE4CPDE4DABCB1 | |
| Bimakalim SCHEMBL231904 | 0.78 | PDE4A (0.43) | PDE4APDE4BPDE4CPDE4DABCB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5296492-A | Certain chroman derivatives useful for treating symptoms caused by contraction of smooth muscles, circulatory diseases or epilepsy | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 1994-03-22 | — | — | US | disclosed |
| EP-0518342-A1 | Chroman derivatives | Nippon Kayaku Kabushiki Kaisha (JP) | 1992-12-16 | — | — | EP | disclosed |