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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.33 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | RARB | P10826 | 1/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | PKM | P14618 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | THPO | P40225 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 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 SCHEMBL7004683 | 0.94 | GPR84 (0.38) | ALDH1A1GPR84HCAR3HCAR2RARB | |
| Acetic Acid SCHEMBL232563 | 0.94 | GPR84 (0.33) | ALDH1A1HPGDHSD17B10GPR84HCAR3 | |
| Propionic Acid SCHEMBL528118 | 0.92 | GPR84 (0.36) | ALDH1A1HPGDHSD17B10GPR84 | |
| Butyric Acid SCHEMBL526832 | 0.89 | FFAR3 (0.41) | GPR84NFKB1 | |
| Pivalate SCHEMBL15287009 | 0.89 | NPC1 (0.32) | HPGDGPR84 | |
| SCHEMBL535111 | 0.89 | CA1 (0.34) | GPR84 | |
| SCHEMBL2719750 | 0.89 | ALDH1A1 (0.31) | ALDH1A1HPGDGPR84 | |
| L-Lactic Acid SCHEMBL3643630 | 0.88 | CA1 (0.33) | GPR84 | |
| Trifluoroacetic Acid SCHEMBL535019 | 0.88 | CCR5 (0.36) | HSD17B10GPR84MEN1CYP1A2KMT2A | |
| SCHEMBL107551 | 0.88 | HRH3 (0.34) | GPR84 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2515827-A2 | CURABLE DENTAL COMPOSITIONS AND ARTICLES COMPRISING POLYMERIZABLE IONIC LIQUIDS | 3M Innovative Properties Company (US) | 2012-10-31 | — | — | EP | disclosed |
| EP-2470509-A2 | COMPOSITIONS AND ARTICLES COMPRISING POLYMERIZABLE IONIC LIQUID MIXTURE, AND METHODS OF CURING | 3M Innovative Properties Company (US) | 2012-07-04 | — | — | EP | disclosed |
| WO-2012078783-A2 | IMMOBILIZATION OF IONIC LIQUIDS VIA MECHNOCHEMICAL INTERCALATION IN LAYERED MATERIALS | TEXAS STATE UNIVERSITY-SAN MARCOS (US) | 2012-06-14 | — | — | WO | disclosed |
| WO-2011087621-A2 | CURABLE DENTAL COMPOSITIONS AND ARTICLES COMPRISING POLYMERIZABLE IONIC LIQUIDS | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2011-07-21 | — | — | WO | disclosed |
| WO-2011025847-A2 | COMPOSITIONS AND ARTICLES COMPRISING POLYMERIZABLE IONIC LIQUID MIXTURE, AND METHODS OF CURING | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2011-03-03 | — | — | WO | disclosed |