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 | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.52 |
| ▸ | CA2 | P00918 | 3/20 | 0.52 |
| ▸ | CA4 | P22748 | 2/20 | 0.52 |
| ▸ | CES2 | O00748 | 7/20 | 0.50 |
| ▸ | CES1 | P23141 | 7/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ASPH | Q12797 | 1/20 | 0.33 |
| ▸ | KDM8 | Q8N371 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 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 SCHEMBL21630455 | 1.00 | CA1 (0.52) | CA1CA2CA4CES2CES1 | |
| Bicarbonate SCHEMBL16932539 | 1.00 | CA1 (0.52) | CA1CA2CA4CES2CES1 | |
| Acetic Acid SCHEMBL27550925 | 0.88 | CA1 (0.48) | CA1CA2CA4CES2CES1 | |
| Acetone SCHEMBL27268203 | 0.85 | CA1 (0.50) | CA1CA2CA4CES2CES1 | |
| Trifluoroacetic Acid SCHEMBL27519545 | 0.84 | CA1 (0.44) | CA1CA2CA4CES2CES1 | |
| SCHEMBL41646 | 0.83 | CA1 (0.43) | CA1CA2CA4CES2CES1 | |
| SCHEMBL7702552 | 0.83 | CA1 (0.43) | CA1CA2CA4CES2CES1 | |
| Propionic Acid SCHEMBL7199224 | 0.82 | FFAR3 (0.48) | CA1CA2CA4CES2CES1 | |
| Methyl Alcohol SCHEMBL27510918 | 0.80 | CA1 (0.43) | CA1CA2CA4CES2CES1 | |
| Formaldehyde SCHEMBL27280878 | 0.80 | CA1 (0.43) | CA1CA2CA4CES2CES1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104628574-A | Carbonate photosensitive reagent, preparation method thereof and preparation method of 5' -photosensitive protection nucleoside | SHI PING | 2015-05-20 | — | — | CN | disclosed |