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 | |
|---|---|---|---|---|
| ▸ | NR4A1 | P22736 | 1/20 | 0.56 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.56 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.56 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.51 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.49 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.49 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.49 |
| ▸ | CDC25B | P30305 | 1/20 | 0.48 |
| ▸ | PPARG | P37231 | 4/20 | 0.47 |
| ▸ | PPARA | Q07869 | 4/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
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 SCHEMBL11569280 | 0.98 | NR4A1 (0.58) | NR4A1NR4A2NR4A3MCL1ACMSD | |
| Bicarbonate SCHEMBL27989801 | 0.92 | HDAC8 (0.53) | NR4A1NR4A2NR4A3MCL1ACMSD | |
| Carbamic Acid SCHEMBL31151006 | 0.88 | ALOX5 (0.54) | NR4A1NR4A2NR4A3MCL1ACMSD | |
| Benzene SCHEMBL28202246 | 0.87 | ALDH1A1 (0.56) | NR4A1NR4A2NR4A3TDP1KDM4E | |
| SCHEMBL28115871 | 0.87 | ALDH1A1 (0.56) | TDP1KDM4EALDH1A1HPGDCYP1A2 | |
| Bicarbonate SCHEMBL27850284 | 0.86 | HDAC8 (0.61) | NR4A1NR4A2NR4A3MCL1ACMSD | |
| SCHEMBL25302086 | 0.84 | ALDH1A1 (0.59) | TDP1KDM4EALDH1A1HPGDCYP1A2 | |
| SCHEMBL27953 | 0.84 | ALDH1A1 (0.59) | TDP1KDM4EALDH1A1HPGDCYP1A2 | |
| SCHEMBL29350007 | 0.84 | ALDH1A1 (0.59) | TDP1KDM4EALDH1A1HPGDCYP1A2 | |
| Bicarbonate SCHEMBL14250780 | 0.84 | HDAC8 (0.49) | NR4A1NR4A2NR4A3MCL1ACMSD |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100448912-C | Method for producing polyester carbonic ester | BAYER AG (DE) | 2009-01-07 | — | — | CN | claimed |
| CN-1412219-A | Method for producing polyester carbonic ester | BAYER AG (DE) | 2003-04-23 | — | — | CN | claimed |
| CN-104540890-A | Products with improved non-flammability | BAYER MATERIALSCIENCE AG | 2015-04-22 | — | — | CN | disclosed |
| CN-102093685-A | Polycarbonate compositions with improved surface hardness | BAYER MATERIALSCIENCE AG | 2011-06-15 | — | — | CN | disclosed |
| CN-102002224-A | Products with improved flame retardancy | BAYER MATERIALSCIENCE AG | 2011-04-06 | — | — | CN | disclosed |
| CN-100448912-C | Method for producing polyester carbonic ester | BAYER AG (DE) | 2009-01-07 | — | — | CN | disclosed |
| CN-100434453-C | Polycarbonates, polyester carbonates and polyesters containing pendant cycloalkyl-substituted phenols | BAYER MATERIALSCIENCE AG (DE) | 2008-11-19 | — | — | CN | disclosed |
| CN-1250602-C | Prepn. of copolymer carbonic ester | BAYER AG (DE) | 2006-04-12 | — | — | CN | disclosed |
| CN-1729227-A | Polycarbonates, polyester carbonates and polyesters containing pendant cycloalkyl-substituted phenols | BAYER MATERIALSCIENCE AG (DE) | 2006-02-01 | — | — | CN | disclosed |
| CN-1412219-A | Method for producing polyester carbonic ester | BAYER AG (DE) | 2003-04-23 | — | — | CN | disclosed |
| CN-1397582-A | Prepn. of copolymer carbonic ester | BAYER AG (DE) | 2003-02-19 | — | — | CN | disclosed |