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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.37 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.31 |
| ▸ | CTSS | P25774 | 1/20 | 0.30 |
| ▸ | CTSK | P43235 | 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 | |
|---|---|---|---|---|
| SCHEMBL29446746 | 0.89 | TSHR (0.31) | TSHR | |
| SCHEMBL111610 | 0.78 | TET2 (0.37) | SLC6A3CYP3A4TSHRNFKB1 | |
| SCHEMBL1163590 | 0.77 | AKR1B1 (0.36) | TDP1TSHR | |
| SCHEMBL3443498 | 0.75 | GPR84 (0.39) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL26073020 | 0.75 | GPR84 (0.39) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL29239964 | 0.73 | HDAC1 (0.42) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL29239965 | 0.73 | HDAC1 (0.42) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| Nitrous Acid SCHEMBL28817705 | 0.73 | GPR84 (0.35) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL16620712 | 0.72 | — | — | |
| SCHEMBL532758 | 0.72 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1948698-A1 | PROCESS FOR PRODUCTION OF POLYMER POWDERS CONTAINING VINYLFORMAMIDE UNITS | BASF SE (DE) | 2008-07-30 | — | — | EP | disclosed |
| WO-2007054442-A1 | PROCESS FOR PRODUCTION OF POLYMER POWDERS CONTAINING VINYLFORMAMIDE UNITS | BASF SE (DE) | 2007-05-18 | — | — | WO | disclosed |