Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.32 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.32 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.32 |
| ▸ | IDH1 | O75874 | 2/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 1/20 | 0.31 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21962071 | 0.85 | ALDH1A1 (0.40) | HSD17B2CA2CA12CA1CA9 | |
| SCHEMBL21962052 | 0.73 | BACE1 (0.41) | CA2CA12CA1CA9 | |
| SCHEMBL22014434 | 0.66 | AGBL2 (0.40) | P2RX1 | |
| SCHEMBL23568744 | 0.66 | CACNA1B (0.50) | HTR2AHTR2CHTR2BEPHX1CA2 | |
| SCHEMBL8191003 | 0.66 | CA2 (0.55) | CA2CA12CA1CA9 | |
| SCHEMBL10182144 | 0.65 | HTR2A (0.41) | HTR2AHTR2CHTR2BRORCSIGMAR1 | |
| SCHEMBL10180467 | 0.64 | HTR2A (0.41) | HTR2AHTR2CHTR2BRORCSIGMAR1 | |
| SCHEMBL23447684 | 0.63 | CA12 (0.55) | CA2CA12CA1CA9NPSR1 | |
| SCHEMBL23665873 | 0.63 | NPC1 (0.42) | HTR2AHTR2CHTR2BCA2 | |
| SCHEMBL13241241 | 0.63 | ALDH1A1 (0.47) | RORC |
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-2020102574-A1 | THE COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY | NOVARTIS INFLAMMASOME RESEARCH, INC. (US) | 2020-05-22 | — | — | WO | disclosed |