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 | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | HNF4A | P41235 | 1/20 | 0.41 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARD | Q03181 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | PLK1 | P53350 | 1/20 | 0.37 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL27480276 | 0.93 | CA2 (0.41) | CA2HNF4APTPN5TDP1ALDH1A1 | |
| SCHEMBL1194487 | 0.93 | CA2 (0.41) | CA2HNF4APTPN5TDP1ALDH1A1 | |
| Phosphine SCHEMBL2238719 | 0.91 | CA2 (0.40) | CA2HNF4APTPN5MEN1KMT2A | |
| Iodide SCHEMBL29162131 | 0.91 | CA2 (0.40) | CA2HNF4APTPN5TDP1ALDH1A1 | |
| SCHEMBL545685 | 0.91 | CA2 (0.40) | CA2HNF4APTPN5TDP1ALDH1A1 | |
| SCHEMBL27587488 | 0.91 | CA2 (0.40) | CA2HNF4APTPN5TDP1ALDH1A1 | |
| SCHEMBL27759190 | 0.85 | CA2 (0.39) | CA2HNF4APTPN5TDP1ALDH1A1 | |
| Bicarbonate SCHEMBL27754489 | 0.85 | ALDH1A1 (0.45) | CA2HNF4APTPN5MEN1KMT2A | |
| Bicarbonate SCHEMBL27471685 | 0.85 | ALDH1A1 (0.45) | CA2HNF4APTPN5MEN1KMT2A | |
| SCHEMBL27795569 | 0.83 | PTPN5 (0.37) | CA2HNF4APTPN5MEN1KMT2A |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104054207-B | Sealed lithium secondary battery | 丰田自动车株式会社 | 2017-02-22 | — | — | CN | disclosed |
| CN-104540890-A | Products with improved non-flammability | BAYER MATERIALSCIENCE AG | 2015-04-22 | — | — | CN | disclosed |
| CN-102101839-B | Polycarbonate with improved thermal and mechanical properties and reduced thermal expansion coefficient | BAYER MATERIALSCIENCE AG | 2014-12-24 | — | — | CN | disclosed |
| CN-102356112-A | Copolycarbonates with improved properties | BAYER MATERIALSCIENCE AG | 2012-02-15 | — | — | CN | disclosed |
| CN-102227463-A | Copolycarbonates with improved surface hardness | BAYER MATERIALSCIENCE AG | 2011-10-26 | — | — | CN | disclosed |
| CN-102101839-A | Polycarbonate with improved thermal and mechanical properties and reduced thermal expansion coefficient | BAYER MATERIALSCIENCE AG | 2011-06-22 | — | — | CN | disclosed |
| CN-102093686-A | Polycarbonate compositions with improved mechanical properties | BAYER MATERIALSCIENCE AG | 2011-06-15 | — | — | CN | disclosed |
| CN-102093687-A | Copolycarbonate compositions with improved thermal properties and based on blends | BAYER MATERIALSCIENCE AG | 2011-06-15 | — | — | 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-100393681-C | Polycarbonates and copolycarbonates having reduced water absorption and improved flow capacity, method for the production and use thereof | BAYER MATERIALSCIENCE AG (DE) | 2008-06-11 | — | — | CN | disclosed |
| CN-1871198-A | Polycarbonates and copolycarbonates having reduced water absorption and improved flow capacity, method for the production and use thereof | BAYER MATERIALSCIENCE AG (DE) | 2006-11-29 | — | — | CN | disclosed |
| CN-1729227-A | Polycarbonates, polyester carbonates and polyesters containing pendant cycloalkyl-substituted phenols | BAYER MATERIALSCIENCE AG (DE) | 2006-02-01 | — | — | CN | disclosed |