Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL18459234 | 0.97 | TSHR (0.38) | TSHRTDP1 | |
| Acetic Acid SCHEMBL27828042 | 0.84 | FFAR3 (0.33) | — | |
| Glycine SCHEMBL27828041 | 0.79 | GLRA1 (0.42) | TDP1 | |
| SCHEMBL598103 | 0.78 | TSHR (0.46) | TSHRTDP1 | |
| SCHEMBL23636213 | 0.78 | TSHR (0.33) | TSHRTDP1 | |
| SCHEMBL21694756 | 0.78 | TSHR (0.33) | TSHRTDP1 | |
| SCHEMBL20273156 | 0.75 | CYP2D6 (0.35) | TSHRTDP1 | |
| SCHEMBL21086576 | 0.75 | TSHR (0.32) | TSHRTDP1 | |
| SCHEMBL10496797 | 0.75 | TSHR (0.32) | TSHRTDP1 | |
| SCHEMBL18544621 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-102060715-A | Double quaternary ammonium carboxylate functional ionic liquid and preparation method thereof | NANJING UNIVERSITY OF TECHNOLOGY | 2011-05-18 | — | — | CN | disclosed |