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.
⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 SCHEMBL27243137 | 0.91 | MEN1 (0.50) | — | |
| Bicarbonate SCHEMBL27243138 | 0.91 | MEN1 (0.50) | — | |
| Bicarbonate SCHEMBL7849764 | 0.91 | MEN1 (0.50) | — | |
| Bicarbonate SCHEMBL28913475 | 0.91 | — | — | |
| Bicarbonate SCHEMBL30989354 | 0.91 | — | — | |
| Bicarbonate SCHEMBL7904530 | 0.91 | — | — | |
| Bicarbonate SCHEMBL30212590 | 0.91 | MEN1 (0.50) | — | |
| Bicarbonate SCHEMBL11215584 | 0.91 | MEN1 (0.50) | — | |
| Bicarbonate SCHEMBL9197417 | 0.91 | MEN1 (0.50) | — | |
| Bicarbonate SCHEMBL7259518 | 0.87 | MEN1 (0.46) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1354008-A2 | PIGMENTS USED TO PRODUCE PAPER | BK Giulini Chemie GmbH & Co. OHG (DE) | 2003-10-22 | — | — | EP | claimed |
| US-20030037895-A1 | Sulfate-containing and aluminum- containing pigments having pseudoboehmitic structural units, produce good printing results with inkjet color printer | BK GIULINI CHEMIE GMBH UND CO OHG (DE) | 2003-02-27 | — | — | US | claimed |
| WO-2002053655-A2 | PIGMENTS USED TO PRODUCE PAPER | BK GIULINI CHEMIE GMBH UND CO OHG (DE) | 2002-07-11 | — | — | WO | claimed |
| EP-1354008-A2 | PIGMENTS USED TO PRODUCE PAPER | BK Giulini Chemie GmbH & Co. OHG (DE) | 2003-10-22 | — | — | EP | disclosed |
| US-20030037895-A1 | Sulfate-containing and aluminum- containing pigments having pseudoboehmitic structural units, produce good printing results with inkjet color printer | BK GIULINI CHEMIE GMBH UND CO OHG (DE) | 2003-02-27 | — | — | US | disclosed |
| WO-2002053655-A2 | PIGMENTS USED TO PRODUCE PAPER | BK GIULINI CHEMIE GMBH UND CO OHG (DE) | 2002-07-11 | — | — | WO | disclosed |