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 | |
|---|---|---|---|---|
| SCHEMBL213709 | 0.89 | PARP1 (0.42) | PARP1TRPA1 | |
| SCHEMBL29696017 | 0.89 | PARP1 (0.42) | PARP1TRPA1 | |
| SCHEMBL6488209 | 0.87 | PARP1 (0.41) | PARP1TRPA1 | |
| SCHEMBL7309901 | 0.81 | PARP1 (0.37) | PARP1TRPA1 | |
| SCHEMBL4969401 | 0.69 | HTR2C (0.43) | PARP1TRPA1 | |
| Formic Acid SCHEMBL27938520 | 0.69 | PARP1 (0.75) | PARP1 | |
| Formic Acid SCHEMBL28034893 | 0.68 | PNMT (0.50) | — | |
| SCHEMBL19540042 | 0.67 | TSHR (0.39) | TRPA1 | |
| Formic Acid SCHEMBL8436468 | 0.64 | CYP1A2 (0.52) | — | |
| SCHEMBL2940889 | 0.63 | TRPA1 (0.44) | TRPA1 |
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-101472899-A | 2-substituted 4-benzylphthalazinone derivatives as histamine H1 and H3 antagonists | GLAXO GROUP LTD (GB) | 2009-07-01 | — | — | CN | disclosed |