Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 8/20 | 0.41 |
| ▸ | CA1 | P00915 | 4/20 | 0.41 |
| ▸ | CA9 | Q16790 | 4/20 | 0.41 |
| ▸ | CA5A | P35218 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HRH1 | P35367 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 3/20 | 0.37 |
| ▸ | CA7 | P43166 | 2/20 | 0.37 |
| ▸ | HTR2A | P28223 | 2/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.35 |
| ▸ | CA3 | P07451 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA6 | P23280 | 1/20 | 0.35 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.35 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.35 |
| ▸ | GBA1 | P04062 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27301528 | 0.83 | GABBR2 (0.41) | CA2CA1CA9CA5ACYP2C19 | |
| SCHEMBL7396037 | 0.82 | HRH1 (0.52) | CA2CA1CA9CA5AHRH1 | |
| SCHEMBL27316010 | 0.80 | CFTR (0.40) | CA2CA1CA9CA12 | |
| SCHEMBL12497701 | 0.78 | GBA1 (0.47) | CA2CA1CA9CA5AGBA1 | |
| SCHEMBL9203881 | 0.77 | CA2 (0.41) | CA2CA1CA9CA5ACYP2C19 | |
| SCHEMBL22042229 | 0.76 | TSHR (0.55) | TSHRHRH1HTR2ATAAR1 | |
| SCHEMBL4444059 | 0.74 | CA2 (0.47) | CA2CA1CA9CA5ACA12 | |
| SCHEMBL3129720 | 0.74 | CYP2C19 (0.41) | CYP2C19TSHRHRH1HTR2A | |
| SCHEMBL27324353 | 0.74 | SLC6A2 (0.37) | CYP2C19TSHRHRH1HTR2A | |
| Sulfamate SCHEMBL9451490 | 0.73 | SRC (0.46) | CA2CA1CA9CA5ACYP2C19 |
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-1127492-C | Antirheumatic | SHIONOJI & CO LTD (JP) | 2003-11-12 | — | — | CN | disclosed |
| CN-1283194-A | Antirheumatic | SHIONOJI & CO LTD (JP) | 2001-02-07 | — | — | CN | disclosed |
| CN-1035614-C | Benzylidene derivatives | SHIONOGI & CO (JP) | 1997-08-13 | — | — | CN | disclosed |
| CN-1092414-A | Benzylidene derivatives | SHIONOGI & CO (JP) | 1994-09-21 | — | — | CN | disclosed |