Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.38 |
| ▸ | KLK7 | P49862 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 4/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL24960540 | 0.92 | TRPM8 (0.36) | TRPM8KLK7NPC1RAB9AALDH1A1 | |
| SCHEMBL23565935 | 0.85 | NPC1 (0.34) | TRPM8KLK7NPC1RAB9AALDH1A1 | |
| SCHEMBL23339950 | 0.85 | NPC1 (0.34) | TRPM8KLK7NPC1RAB9AALDH1A1 | |
| SCHEMBL23966742 | 0.83 | TRPM8 (0.41) | TRPM8KLK7NPC1RAB9AALDH1A1 | |
| SCHEMBL22818952 | 0.80 | NR1I2 (0.35) | TRPM8KLK7NPC1RAB9AALDH1A1 | |
| SCHEMBL24959785 | 0.78 | KDM4E (0.30) | ALDH1A1MAPTKDM4E | |
| SCHEMBL24956816 | 0.77 | ALDH1A1 (0.35) | ALDH1A1LMNA | |
| SCHEMBL12310758 | 0.73 | TRPM8 (0.44) | TRPM8NPC1RAB9AALDH1A1GAA | |
| SCHEMBL24959718 | 0.73 | NOS2 (0.30) | — | |
| SCHEMBL24959706 | 0.73 | ALDH1A1 (0.33) | ALDH1A1LMNA |
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-2023288253-A1 | SMALL MOLECULES INHIBITORS OF CYCLIC GMP-AMP SYNTHASE (CGAS) | THE SCRIPPS RESEARCH INSTITUTE (US) | 2023-01-19 | — | — | WO | disclosed |