Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | SLC9A1 | P19634 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | XDH | P47989 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | HGFAC | Q04756 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1574104 | 0.75 | PTPRC (0.49) | KDM4ECA1CA2CA9ALDH1A1 | |
| SCHEMBL18445867 | 0.75 | CA1 (0.51) | CA1CA2CA9 | |
| SCHEMBL8058100 | 0.72 | — | — | |
| SCHEMBL8062892 | 0.72 | HTR2B (0.42) | SLC9A1HTR7HTR2BSLC9A2 | |
| SCHEMBL8062884 | 0.72 | SLC9A1 (0.40) | SLC9A1HTR7HTR2BSLC9A2 | |
| SCHEMBL8056981 | 0.71 | HTR2B (0.41) | SLC9A1HTR7HTR2BSLC9A2 | |
| SCHEMBL8058131 | 0.69 | HTR7 (0.40) | SLC9A1HTR7HTR2BSLC9A2 | |
| SCHEMBL8058156 | 0.69 | HTR2B (0.45) | HTR7HTR2B | |
| SCHEMBL8063082 | 0.69 | HTR2B (0.47) | SLC9A1HTR7HTR2BSLC9A2 | |
| SCHEMBL8056270 | 0.68 | HTR2B (0.48) | CA1CA2CA9HTR7HTR2B |
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 |
|---|---|---|---|---|---|---|---|
| US-6028069-A | Heterocyclyl-condensed benzoylguanidines, their production and use as inhibitors of the cellular Na+/H+-antiporter | MERCK PATENT GESELLSCHAFT MIT BERSCHRANKER HAFTUNG (DE) | 2000-02-22 | — | — | US | disclosed |