Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | GLP1R | P43220 | 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 | |
|---|---|---|---|---|
| SCHEMBL9925835 | 0.81 | CA1 (0.35) | CA1CA2 | |
| SCHEMBL9900886 | 0.65 | GLP1R (0.35) | GLP1R | |
| SCHEMBL1173555 | 0.65 | RAB9A (0.40) | CA1CA2 | |
| SCHEMBL25430536 | 0.64 | SLC22A12 (0.40) | CA1CA2 | |
| SCHEMBL26608389 | 0.64 | GLP1R (0.36) | CA1CA2GLP1R | |
| SCHEMBL31440813 | 0.64 | GLP1R (0.36) | CA1CA2GLP1R | |
| SCHEMBL210383 | 0.61 | ALPL (0.40) | CA1CA2 | |
| SCHEMBL12970127 | 0.61 | CA1 (0.37) | CA1CA2 | |
| SCHEMBL12681353 | 0.61 | CA2 (0.33) | CA1CA2 | |
| SCHEMBL31548571 | 0.61 | PPARG (0.35) | CA1CA2CYP1A2CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012076966-A1 | SUBSTITUTED THIENO [3,4-B] PYRAZINE COMPOUNDS | LUPIN LIMITED (IN) | 2012-06-14 | — | — | WO | disclosed |