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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.40 |
| ▸ | HTR2C | P28335 | 4/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 2/20 | 0.35 |
| ▸ | MMP2 | P08253 | 2/20 | 0.35 |
| ▸ | MMP3 | P08254 | 2/20 | 0.35 |
| ▸ | MMP9 | P14780 | 2/20 | 0.35 |
| ▸ | MMP8 | P22894 | 2/20 | 0.35 |
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 SCHEMBL7806502 | 1.00 | HTR2A (0.40) | HTR2AHTR2CHDAC2KCNH2HDAC1 | |
| SCHEMBL175610 | 0.92 | TRPA1 (0.40) | HTR2AHTR2CHDAC2KCNH2HDAC1 | |
| SCHEMBL4249764 | 0.92 | TRPA1 (0.40) | HTR2AHTR2CHDAC2KCNH2HDAC1 | |
| SCHEMBL29410976 | 0.92 | TRPA1 (0.40) | HTR2AHTR2CHDAC2KCNH2HDAC1 | |
| SCHEMBL175609 | 0.92 | TRPA1 (0.40) | HTR2AHTR2CHDAC2KCNH2HDAC1 | |
| Sulfuric Acid SCHEMBL8584224 | 0.91 | HTR2A (0.38) | HTR2AHTR2CHDAC2KCNH2HDAC1 | |
| SCHEMBL327320 | 0.91 | TRPA1 (0.39) | HTR2AHTR2CHDAC2KCNH2HDAC1 | |
| SCHEMBL9121829 | 0.91 | TRPA1 (0.39) | HTR2AHTR2CHDAC2KCNH2HDAC1 | |
| SCHEMBL183120 | 0.91 | TRPA1 (0.39) | HTR2AHTR2CHDAC2KCNH2HDAC1 | |
| SCHEMBL4997533 | 0.91 | TRPA1 (0.39) | HTR2AHTR2CHDAC2KCNH2HDAC1 |
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-1141194-A1 | DETERGENT COMPOSITIONS HAVING A CELLULOSE POLYMER | THE PROCTER & GAMBLE COMPANY (US) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000042144-A1 | DETERGENT COMPOSITIONS HAVING A CELLULOSE POLYMER | THE PROCTER & GAMBLE COMPANY (US) | 2000-07-20 | — | — | WO | disclosed |