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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | CHRNB2 | P17787 | 4/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 4/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.37 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.37 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2924441 | 0.87 | HTT (0.48) | HTTCHRNB2CHRNA4CHRM2CHRM4 | |
| Carbamic Acid SCHEMBL17473082 | 0.83 | HTT (0.42) | HTTCHRNB2CHRNA4CHRM2CHRM4 | |
| Bicarbonate SCHEMBL6460997 | 0.81 | HTT (0.43) | HTTALDH1A1MEN1TSHRKMT2A | |
| Phosphonic Acid SCHEMBL8154966 | 0.79 | HTT (0.42) | HTTCHRNB2CHRNA4CHRM2CHRM4 | |
| SCHEMBL18525702 | 0.72 | CHRNB2 (0.45) | HTTCHRNB2CHRNA4CHRM2CHRM4 | |
| SCHEMBL8238293 | 0.71 | HTT (0.36) | HTTCHRNB2CHRNA4CHRM2CHRM4 | |
| SCHEMBL17471841 | 0.69 | CHRNB2 (0.42) | HTTCHRNB2CHRNA4CHRM2CHRM4 | |
| SCHEMBL871325 | 0.69 | HTT (0.43) | HTTALDH1A1MEN1TSHRKMT2A | |
| SCHEMBL14999298 | 0.69 | ALDH1A1 (0.58) | CHRNB2CHRNA4CHRM2CHRM4CHRM5 | |
| SCHEMBL18525699 | 0.69 | CHRNB2 (0.38) | CHRNB2CHRNA4CHRM2CHRM4CHRM5 |
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 |
|---|---|---|---|---|---|---|---|
| US-6159640-A | Electrolyte system for lithium batteries and use of said system, and method for increasing the safety of lithium batteries | HOECHST RESEARCH & TECHNOLOGY GMBH & CO. KG (DE) | 2000-12-12 | — | — | US | disclosed |