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 | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | CRHBP | P24387 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.30 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL7739518 | 1.00 | THRB (0.33) | THRBCYP2C9EPHX1EPHX2ALDH1A1 | |
| SCHEMBL28497384 | 0.90 | GRIN2D (0.32) | — | |
| SCHEMBL7733357 | 0.90 | GLA (0.30) | THRBCYP2C9GLA | |
| SCHEMBL5357358 | 0.74 | THRB (0.34) | THRBCYP2C9EPHX1EPHX2ALDH1A1 | |
| Bicarbonate SCHEMBL2521295 | 0.73 | THRB (0.33) | THRBCYP2C9EPHX1EPHX2ALDH1A1 | |
| SCHEMBL1088728 | 0.72 | THRB (0.35) | THRBCYP2C9EPHX1EPHX2ALDH1A1 | |
| SCHEMBL6941643 | 0.70 | ITGB1 (0.34) | THRBCYP2C9EPHX1EPHX2ALDH1A1 | |
| Bicarbonate SCHEMBL7732897 | 0.69 | HSD11B1 (0.36) | THRBCYP2C9EPHX1EPHX2ALDH1A1 | |
| Bicarbonate SCHEMBL7739291 | 0.69 | HSD11B1 (0.36) | THRBCYP2C9EPHX1EPHX2ALDH1A1 | |
| SCHEMBL5672652 | 0.69 | SLC22A2 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6410748-B1 | Alicycli c group-containing monomer | KABUSHIKI KAISHA TOSHIBA (JP) | 2002-06-25 | — | — | US | disclosed |
| US-6291129-B1 | LIGHT SENSITIVE ELEMENT WITH UNSATURATED POLYMERS | KABUSHIKI KAISHA TOSHIBA (JP) | 2001-09-18 | — | — | US | disclosed |