Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH5 | P11766 | 9/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.37 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | ICAM1 | P05362 | 2/20 | 0.35 |
| ▸ | SELE | P16581 | 2/20 | 0.35 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | MITF | O75030 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | SYK | P43405 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL18019394 | 0.86 | PDE4A (0.37) | ADH5PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL18019415 | 0.82 | ADH5 (0.35) | ADH5PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL18019397 | 0.82 | ADH5 (0.40) | ADH5PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL17977419 | 0.81 | ADH5 (0.46) | ADH5PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL17977275 | 0.81 | ICAM1 (0.45) | ADH5PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL17977380 | 0.79 | ADH5 (0.44) | ADH5PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4674986 | 0.78 | PDE4A (0.46) | ADH5PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL17977334 | 0.78 | ADH5 (0.54) | ADH5PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL17977424 | 0.77 | ADH5 (0.41) | ADH5PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL17977328 | 0.76 | ADH5 (0.36) | ADH5PDE4APDE4BPDE4CPDE4D |
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-2016128905-A1 | THIENOPYRROLE COMPOUNDS AS S-NITROSOGLUTATHIONE REDUCTASE INHIBITORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2016-08-18 | — | — | WO | disclosed |