Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 1/20 | 0.51 |
| ▸ | CA9 | Q16790 | 1/20 | 0.51 |
| ▸ | HTR6 | P50406 | 3/20 | 0.47 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | ALPL | P05186 | 1/20 | 0.45 |
| ▸ | ALPI | P09923 | 1/20 | 0.45 |
| ▸ | ALPG | P10696 | 1/20 | 0.45 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.45 |
| ▸ | PGAM1 | P18669 | 2/20 | 0.44 |
| ▸ | F2 | P00734 | 2/20 | 0.44 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.44 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.44 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7190517 | 0.84 | CA1 (0.60) | CA1CA2CA9HTR6HCRTR1 | |
| SCHEMBL547461 | 0.80 | CA1 (0.68) | CA1CA2CA9HTR6HCRTR1 | |
| SCHEMBL7175789 | 0.78 | CA1 (0.65) | CA1CA2CA9HTR6HCRTR1 | |
| SCHEMBL22647140 | 0.78 | POLB (0.50) | HTR6TDP1MEN1KMT2ACDK2 | |
| SCHEMBL9456434 | 0.77 | CA1 (0.55) | CA1CA2CA9HTR6HCRTR1 | |
| Phosphonic Acid SCHEMBL28657855 | 0.75 | CA1 (0.57) | CA1CA2CA9HTR6HCRTR1 | |
| SCHEMBL5153341 | 0.75 | HTR6 (0.57) | CA1CA2CA9HTR6HCRTR1 | |
| Pyrogallol SCHEMBL28731616 | 0.75 | CA1 (0.56) | CA1CA2CA9HTR6HCRTR1 | |
| SCHEMBL7196896 | 0.74 | ALPL (0.61) | CA1CA2CA9HTR6HCRTR1 | |
| SCHEMBL10610440 | 0.74 | ALPL (0.81) | CA1CA2CA9HTR6HCRTR1 |
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-2020227180-A1 | SULFUR AND AMIDE TROPOLONE INHIBITORS OF NUCLEOTIDYL TRANSFERASES AND USES THEREFOR | SAINT LOUIS UNIVERSITY (US) | 2020-11-12 | — | — | WO | disclosed |