Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.58 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.58 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.58 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.57 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.36 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | HTR6 | P50406 | 1/20 | 0.31 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.30 |
| ▸ | MMP2 | P08253 | 1/20 | 0.30 |
| ▸ | MMP9 | P14780 | 1/20 | 0.30 |
| ▸ | MMP13 | P45452 | 1/20 | 0.30 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14562855 | 0.90 | KCNH2 (0.68) | PTGS1SLC6A2SLC6A4KCNH2CACNA1C | |
| SCHEMBL3466816 | 0.90 | KCNH2 (0.68) | PTGS1SLC6A2SLC6A4KCNH2CACNA1C | |
| Hydrochloric Acid SCHEMBL5539596 | 0.89 | KCNH2 (0.67) | PTGS1SLC6A2SLC6A4KCNH2CACNA1C | |
| Hydrochloric Acid SCHEMBL5539600 | 0.89 | KCNH2 (0.67) | PTGS1SLC6A2SLC6A4KCNH2CACNA1C | |
| SCHEMBL5547591 | 0.83 | KCNH2 (0.68) | PTGS1SLC6A2SLC6A4KCNH2CACNA1C | |
| SCHEMBL5542718 | 0.83 | KCNH2 (0.68) | PTGS1SLC6A2SLC6A4KCNH2CACNA1C | |
| SCHEMBL5546516 | 0.83 | KCNH2 (0.68) | PTGS1SLC6A2SLC6A4KCNH2CACNA1C | |
| SCHEMBL3466039 | 0.82 | PTGS1 (0.58) | PTGS1SLC6A2SLC6A4KCNH2CACNA1C | |
| SCHEMBL2094108 | 0.81 | KCNH2 (0.68) | PTGS1SLC6A2SLC6A4KCNH2CACNA1C | |
| SCHEMBL5542442 | 0.81 | KCNH2 (0.68) | PTGS1SLC6A2SLC6A4KCNH2CACNA1C |
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-2008008480-A2 | NITROHETEROARYL-CONTAINING RIFAMYCIN DERIVATIVES | CUMBRE PHARMACEUTICALS INC. (US) | 2008-01-17 | — | — | WO | disclosed |