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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL932027 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL933127 | 0.90 | — | — | |
| SCHEMBL27674320 | 0.76 | — | — | |
| SCHEMBL933257 | 0.74 | — | — | |
| SCHEMBL27971657 | 0.74 | TSHR (0.44) | — | |
| SCHEMBL34471209 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL21408262 | 0.72 | — | — | |
| SCHEMBL4436164 | 0.72 | — | — | |
| Acetic Acid SCHEMBL27989984 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL28670350 | 0.71 | — | — |
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-104910161-B | Pyrazolopyrimidine compound and method as JAK inhibitor | 健泰科生物技术公司 | 2018-03-30 | — | — | CN | disclosed |