Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | CES1 | P23141 | 6/20 | 0.41 |
| ▸ | CES2 | O00748 | 5/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL8729890 | 0.82 | CA1 (0.46) | CA1CES1CES2CA2 | |
| Succinic Acid SCHEMBL2808150 | 0.80 | CA1 (0.58) | CA1CES1CES2NFKB1CA2 | |
| Oxalic Acid SCHEMBL10430586 | 0.80 | CA1 (0.44) | CA1CES1CES2CA2 | |
| Acetic Acid SCHEMBL11663016 | 0.80 | CES1 (0.44) | CA1CES1CES2CA2 | |
| Acetic Acid SCHEMBL62981 | 0.80 | CES1 (0.44) | CA1CES1CES2CA2 | |
| Acetic Acid SCHEMBL23327569 | 0.80 | CES1 (0.44) | CA1CES1CES2CA2 | |
| SCHEMBL9470936 | 0.80 | RNPEP (0.42) | CA1CES1CES2NFKB1CA2 | |
| SCHEMBL7162235 | 0.79 | CA1 (0.41) | CA1CES1CES2NFKB1CA2 | |
| SCHEMBL11879748 | 0.79 | CA1 (0.50) | CA1CES1CES2NFKB1CA2 | |
| Adipic Acid SCHEMBL2569824 | 0.78 | CA1 (0.62) | CA1CES1CES2NFKB1 |
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-4179432-A | 2-HYDROXYBENZOPHENONE, ORGANOTIN MERCAPTIDE PHOTOSTABILITY | CINCINNATI MILACRON CHEMICALS, INC. (US) | 1979-12-18 | — | — | US | disclosed |