Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Thioglycolic Acid SCHEMBL332197 | 1.00 | FFAR3 (0.36) | FFAR3TSHRCYP2D6CYP2C19HDAC3 | |
| Mercaptopropionic Acid SCHEMBL331386 | 0.84 | ACE (0.43) | FFAR3TSHRHDAC3HDAC1HDAC2 | |
| Thioglycolic Acid SCHEMBL28107448 | 0.83 | TSHR (0.36) | FFAR3TSHRCYP2D6CYP2C19HDAC3 | |
| Thioglycolic Acid SCHEMBL890671 | 0.83 | TSHR (0.36) | FFAR3TSHRCYP2D6CYP2C19HDAC3 | |
| Thioglycolic Acid SCHEMBL18423175 | 0.81 | — | — | |
| Thioglycolic Acid SCHEMBL331990 | 0.81 | FFAR3 (0.42) | FFAR3TSHRCYP2D6CYP2C19HDAC3 | |
| SCHEMBL663125 | 0.78 | — | — | |
| Thioglycolic Acid SCHEMBL331396 | 0.76 | FFAR3 (0.35) | FFAR3TSHRCYP2D6CYP2C19HDAC3 | |
| Thioglycolic Acid SCHEMBL18423900 | 0.76 | — | — | |
| Thioglycolic Acid SCHEMBL331620 | 0.75 | FFAR3 (0.39) | FFAR3TSHRCYP2D6CYP2C19HDAC3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110446696-A | The manufacturing method of multi-thiol compound, polymerizable composition, polymerizable composition and application thereof | MITSUI CHEMICALS INC | 2019-11-12 | — | — | CN | disclosed |
| CN-109153637-A | Xylylene diisocyanate composition, xylylene diisocyanate modified product composition, two-pack type resin raw material, and resin | 三井化学株式会社 | 2019-01-04 | — | — | CN | disclosed |
| CN-106947044-A | Polyisocyantates composition, solar cell component lining material, micro-capsule and ink adhesive | 三井化学株式会社 | 2017-07-14 | — | — | CN | disclosed |
| CN-105793738-A | POLYMERIZABLE COMPOSITION FOR OPTICAL MATERIALS, OPTICAL MATERIAL AND METHOD FOR PRODUCING SAME | 三井化学株式会社 | 2016-07-20 | — | — | CN | disclosed |