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 | |
|---|---|---|---|---|
| ▸ | FFAR3 | O14843 | 2/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.39 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
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 SCHEMBL378701 | 0.96 | FFAR3 (0.44) | FFAR3CHRM2CHRM4CHRM5CHRM1 | |
| Bicarbonate SCHEMBL60768 | 0.96 | FFAR3 (0.44) | FFAR3CHRM2CHRM4CHRM5CHRM1 | |
| Bicarbonate SCHEMBL4800891 | 0.93 | FFAR3 (0.41) | FFAR3CHRM2CHRM4CHRM5CHRM1 | |
| Bicarbonate SCHEMBL28088226 | 0.93 | FFAR3 (0.41) | FFAR3CHRM2CHRM4CHRM5CHRM1 | |
| Bicarbonate SCHEMBL4800886 | 0.93 | FFAR3 (0.41) | FFAR3CHRM2CHRM4CHRM5CHRM1 | |
| Bicarbonate SCHEMBL28103153 | 0.93 | FFAR3 (0.41) | FFAR3CHRM2CHRM4CHRM5CHRM1 | |
| Bicarbonate SCHEMBL4312446 | 0.93 | FFAR3 (0.41) | FFAR3CHRM2CHRM4CHRM5CHRM1 | |
| Bicarbonate SCHEMBL10783748 | 0.90 | ALDH1A1 (0.40) | FFAR3CHRM2CHRM4CHRM5CHRM1 | |
| Bicarbonate SCHEMBL28333973 | 0.90 | FFAR3 (0.39) | FFAR3CHRM2CHRM4CHRM5CHRM1 | |
| Isobutane SCHEMBL27500548 | 0.87 | CHRM2 (0.43) | FFAR3CHRM2CHRM4CHRM5CHRM1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114349968-B | POSS (polyhedral oligomeric silsesquioxane) modified phosphazene flame retardant and preparation method thereof, polycarbonate flame-retardant composite material and preparation method thereof | 万华化学（宁波）有限公司 | 2023-03-24 | — | — | CN | disclosed |
| CN-114349968-A | POSS (polyhedral oligomeric silsesquioxane) modified phosphazene flame retardant and preparation method thereof, polycarbonate flame-retardant composite material and preparation method thereof | 万华化学（宁波）有限公司 | 2022-04-15 | — | — | CN | disclosed |
| CN-110520422-A | Novel pyridone carboxylic acid derivatives or its salt | WAKUNAGA PHARMA CO LTD | 2019-11-29 | — | — | CN | disclosed |
| CN-109053677-A | A kind of preparation method of aromatic ring bithiophene -1,1- dioxide | 济南韶远医药技术有限公司 | 2018-12-21 | — | — | CN | disclosed |
| CN-104350038-B | Method for producing azide compound and method for producing 1H-tetrazole derivative | 日本曹达株式会社 | 2017-05-24 | — | — | CN | disclosed |
| CN-104334552-B | Fused heterocyclic compound | 住友化学株式会社 | 2016-08-31 | — | — | CN | disclosed |