Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 4/20 | 0.35 |
| ▸ | JAK1 | P23458 | 4/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.35 |
| ▸ | ESR1 | P03372 | 3/20 | 0.35 |
| ▸ | TYK2 | P29597 | 3/20 | 0.35 |
| ▸ | JAK3 | P52333 | 3/20 | 0.35 |
| ▸ | NOS1 | P29475 | 4/20 | 0.35 |
| ▸ | AXL | P30530 | 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 | |
|---|---|---|---|---|
| SCHEMBL21196087 | 0.78 | TRPA1 (0.41) | TRPA1CCNA2CDK2CCNA1IDO1 | |
| SCHEMBL24373847 | 0.78 | NOS1 (0.46) | TRPA1CCNA2CDK2CCNA1IDO1 | |
| SCHEMBL9939628 | 0.78 | IDO1 (0.40) | TRPA1CCNA2CDK2CCNA1IDO1 | |
| SCHEMBL29517434 | 0.78 | IDO1 (0.40) | TRPA1CCNA2CDK2CCNA1IDO1 | |
| SCHEMBL20439436 | 0.76 | TRPA1 (0.42) | TRPA1CCNA2CDK2CCNA1IDO1 | |
| SCHEMBL22967212 | 0.75 | NOS1 (0.46) | TRPA1CCNA2CDK2CCNA1IDO1 | |
| SCHEMBL23685818 | 0.75 | TRPA1 (0.44) | TRPA1CCNA2CDK2CCNA1IDO1 | |
| SCHEMBL27192232 | 0.75 | NOS1 (0.42) | TRPA1CCNA2CDK2CCNA1IDO1 | |
| SCHEMBL61091 | 0.74 | TRPA1 (0.38) | TRPA1CCNA2CDK2CCNA1IDO1 | |
| SCHEMBL23977589 | 0.72 | TRPA1 (0.39) | TRPA1CCNA2CDK2CCNA1IDO1 |
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 |
|---|---|---|---|---|---|---|---|
| US-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |