Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 6/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 9/20 | 0.37 |
| ▸ | CA1 | P00915 | 5/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ABCC9 | O60706 | 1/20 | 0.37 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.37 |
| ▸ | KCNJ11 | Q14654 | 1/20 | 0.37 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.37 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.37 |
| ▸ | KCNJ8 | Q15842 | 1/20 | 0.37 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL22012302 | 0.79 | ENPP2 (0.47) | POLBALDH1A1 | |
| SCHEMBL22013719 | 0.77 | AKR1C3 (0.34) | HSD11B1CA2CA1MEN1KMT2A | |
| SCHEMBL3637984 | 0.76 | CA2 (0.55) | HSD11B1CA2CA1MEN1KMT2A | |
| SCHEMBL20681591 | 0.75 | HSD11B1 (0.42) | HSD11B1CA2CA1MEN1KMT2A | |
| SCHEMBL22013008 | 0.72 | NLRP3 (0.42) | CA2 | |
| SCHEMBL22020165 | 0.72 | CA2 (0.36) | CA2 | |
| SCHEMBL2906790 | 0.72 | HSD11B1 (0.65) | HSD11B1ALDH1A1 | |
| SCHEMBL4498767 | 0.72 | CA2 (0.61) | HSD11B1CA2CA1MEN1KMT2A | |
| SCHEMBL6862811 | 0.70 | HSD11B1 (0.53) | HSD11B1POLBMEN1KMT2AALDH1A1 | |
| SCHEMBL13239460 | 0.70 | ENPP2 (0.54) | HSD11B1EPHX2NR1H4ALDH1A1NR1I2 |
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-2020102576-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY | NOVARTIS INFLAMMASOME RESEARCH, INC. (US) | 2020-05-22 | — | — | WO | disclosed |