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 | |
|---|---|---|---|---|
| SCHEMBL1876325 | 0.90 | SHBG (0.36) | SHBGCYP1A2 | |
| Water SCHEMBL1880194 | 0.87 | SHBG (0.35) | SHBGCYP1A2 | |
| Fluoride Ion SCHEMBL1502814 | 0.87 | SHBG (0.35) | SHBGCYP1A2 | |
| Iodide SCHEMBL1502855 | 0.87 | SHBG (0.35) | SHBGCYP1A2 | |
| Hydrochloric Acid SCHEMBL1502867 | 0.87 | SHBG (0.35) | SHBGCYP1A2 | |
| Bromide SCHEMBL1502906 | 0.87 | SHBG (0.35) | SHBGCYP1A2 | |
| SCHEMBL1880759 | 0.87 | SHBG (0.32) | SHBGCYP1A2 | |
| SCHEMBL2149788 | 0.86 | SHBG (0.31) | SHBGCYP1A2 | |
| Water SCHEMBL1876391 | 0.85 | SHBG (0.31) | SHBG | |
| SCHEMBL27817424 | 0.84 | SHBG (0.30) | SHBG |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101384636-B | Polymerizable composition for polythiourethane optical material | MITSU CHEMICALS INC | 2013-02-13 | — | — | CN | disclosed |
| CN-101384636-A | Polymerizable composition for polythiourethane optical material | MITSUI CHEMICALS INC (JP) | 2009-03-11 | — | — | CN | disclosed |