Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Bicarbonate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE7A | Q13946 | 20/20 | 0.84 |
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 SCHEMBL14775793 | 1.00 | PDE7A (0.84) | PDE7A | |
| SCHEMBL854148 | 0.98 | PDE7A (0.88) | PDE7A | |
| SCHEMBL854150 | 0.98 | PDE7A (0.88) | PDE7A | |
| SCHEMBL854824 | 0.95 | PDE7A (0.92) | PDE7A | |
| SCHEMBL853036 | 0.94 | PDE7A (0.86) | PDE7A | |
| SCHEMBL853037 | 0.94 | PDE7A (0.86) | PDE7A | |
| Bicarbonate SCHEMBL14775783 | 0.93 | PDE7A (0.82) | PDE7A | |
| SCHEMBL14775732 | 0.92 | PDE7A (1.00) | PDE7A | |
| SCHEMBL853441 | 0.92 | PDE7A (1.00) | PDE7A | |
| SCHEMBL853941 | 0.92 | PDE7A (1.00) | PDE7A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1775298-B1 | THIENOPYRAZOLE DERIVATIVE HAVING PDE7 INHIBITORY ACTIVITY | DAIICHI SANKYO CO LTD (JP) | 2013-03-20 | — | — | EP | claimed |