Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | F2 | P00734 | 2/20 | 0.38 |
| ▸ | F10 | P00742 | 2/20 | 0.38 |
| ▸ | PLAU | P00749 | 2/20 | 0.38 |
| ▸ | PLAT | P00750 | 2/20 | 0.38 |
| ▸ | PLG | P00747 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.38 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.38 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.38 |
| ▸ | C1S | P09871 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 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 | |
|---|---|---|---|---|
| SCHEMBL24006760 | 0.82 | TRPA1 (0.48) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| SCHEMBL2107802 | 0.79 | PRSS1 (0.48) | F2F10PLAUPLATPLG | |
| SCHEMBL14122570 | 0.79 | ELANE (0.39) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| SCHEMBL24006895 | 0.76 | TRPA1 (0.40) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| SCHEMBL2154328 | 0.76 | LMNA (0.37) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| SCHEMBL15543688 | 0.75 | GABRA1 (0.48) | LMNASLC6A2HTR2BF2F10 | |
| SCHEMBL6644184 | 0.74 | CSNK2A1 (0.52) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| SCHEMBL18575647 | 0.74 | F2 (0.36) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| SCHEMBL24014347 | 0.74 | TRPA1 (0.38) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| SCHEMBL24007492 | 0.74 | TRPA1 (0.41) | TRPA1LMNACHRM1SLC6A2ADRA1A |
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-2021226269-A1 | HETEROAROMATIC MACROCYCLIC ETHER CHEMOTHERAPEUTIC AGENTS | NUVALENT, INC. (US) | 2021-11-11 | — | — | WO | disclosed |