Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.42 |
| ▸ | THRB | P10828 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23837533 | 0.79 | LMNA (0.34) | THRBLMNAKMT2APOLB | |
| SCHEMBL23837549 | 0.79 | TRPA1 (0.41) | TRPA1LMNAKMT2ATSHRTDP1 | |
| SCHEMBL23837600 | 0.78 | TBXAS1 (0.39) | KMT2ATSHRTDP1ALDH1A1TP53 | |
| SCHEMBL17337088 | 0.77 | THRB (0.40) | TRPA1THRBLMNAKMT2ATSHR | |
| SCHEMBL17337091 | 0.77 | THRB (0.40) | TRPA1THRBLMNAKMT2ATSHR | |
| SCHEMBL23837590 | 0.72 | ALDH1A1 (0.39) | TRPA1LMNATSHRTDP1L3MBTL1 | |
| SCHEMBL23130227 | 0.72 | KMT2A (0.44) | THRBLMNAKMT2ATSHRPOLB | |
| SCHEMBL18966871 | 0.70 | TRPA1 (0.35) | TRPA1LMNATSHRTDP1L3MBTL1 | |
| SCHEMBL23130215 | 0.69 | ALDH1A1 (0.43) | KMT2ATSHRALDH1A1 | |
| SCHEMBL23837583 | 0.68 | TSHR (0.35) | TRPA1LMNAKMT2ATSHRL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3882252-A1 | BETA-LACTAMASE INHIBITORS | Venatorx Pharmaceuticals, Inc. (US) | 2021-09-22 | — | — | EP | disclosed |