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 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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL3702928 | 0.91 | PTGES (0.49) | PTGS2PTGES | |
| SCHEMBL3700504 | 0.91 | PTGS2 (0.52) | PTGS2PTGES | |
| SCHEMBL3702231 | 0.89 | PTGS2 (0.40) | PTGS2PTGES | |
| SCHEMBL1179033 | 0.88 | PTGS2 (0.42) | PTGS2PTGES | |
| SCHEMBL1179034 | 0.86 | PTGS2 (0.44) | PTGS2PTGES | |
| SCHEMBL1193466 | 0.85 | PTGES (0.58) | PTGS2PTGES | |
| Bicarbonate SCHEMBL1080702 | 0.84 | PTGES (0.48) | PTGS2PTGES | |
| SCHEMBL12872096 | 0.84 | PTGS2 (0.39) | PTGS2PTGES | |
| Bicarbonate SCHEMBL1080560 | 0.84 | PTGES (0.42) | PTGS2PTGES | |
| SCHEMBL3700059 | 0.83 | PTGES (0.62) | PTGS2PTGES |
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-2268625-B1 | OXO-HETEROCYCLIC SUBSTITUTED CARBOXYLIC ACID DERIVATES AND THE USE THEREOF | Bayer Pharma AG (DE) | 2012-05-16 | — | — | EP | disclosed |