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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | GFER | P55789 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA4 | P22748 | 1/20 | 0.46 |
| ▸ | CA6 | P23280 | 1/20 | 0.46 |
| ▸ | CA5A | P35218 | 1/20 | 0.46 |
| ▸ | CA7 | P43166 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 4/20 | 0.46 |
| ▸ | MAOA | P21397 | 2/20 | 0.46 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.46 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.43 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL54121 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL864912 | 0.87 | ALDH1A1 (0.55) | TSHRTDP1GFERALDH1A1CYP3A4 | |
| SCHEMBL28362411 | 0.87 | ALDH1A1 (0.55) | TSHRTDP1GFERALDH1A1CYP3A4 | |
| SCHEMBL28636090 | 0.87 | ALDH1A1 (0.52) | TSHRTDP1ALDH1A1CA1CA2 | |
| Aminobenzoic Acid SCHEMBL2107999 | 0.87 | ALDH1A1 (0.52) | TSHRTDP1ALDH1A1CA1CA2 | |
| Aminobenzoic Acid SCHEMBL5068633 | 0.85 | ALDH1A1 (0.50) | TSHRTDP1ALDH1A1CA1CA2 | |
| Nitrogen SCHEMBL28369296 | 0.84 | ALDH1A1 (0.52) | TSHRTDP1GFERALDH1A1CYP3A4 | |
| Methyl Alcohol SCHEMBL28089962 | 0.84 | TSHR (0.52) | TSHRTDP1GFERALDH1A1CYP3A4 | |
| Sulfuric Acid SCHEMBL28338120 | 0.83 | CA1 (0.56) | TSHRTDP1GFERALDH1A1CYP3A4 | |
| SCHEMBL1309905 | 0.82 | CYP3A4 (0.58) | TSHRTDP1GFERALDH1A1CYP3A4 |
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-2448929-A1 | NOVEL CONJUGATES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF | SANOFI (FR) | 2012-05-09 | — | — | EP | disclosed |
| WO-2011001052-A1 | NOVEL CONJUGATES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF | SANOFI-AVENTIS (FR) | 2011-01-06 | — | — | WO | disclosed |