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 | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | CES2 | O00748 | 1/20 | 0.56 |
| ▸ | CES1 | P23141 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.50 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL28903026 | 0.92 | SMN1; SMN2 (0.60) | SMN1; SMN2MAPTCES2CES1MEN1 | |
| SCHEMBL9151579 | 0.90 | SMN1; SMN2 (0.52) | SMN1; SMN2MAPTCES2CES1MEN1 | |
| Tannin Pyrogallol SCHEMBL1419994 | 0.89 | ACHE (0.62) | SMN1; SMN2MAPTMEN1KMT2ALMNA | |
| SCHEMBL22079642 | 0.89 | ACHE (0.62) | SMN1; SMN2MAPTMEN1KMT2ALMNA | |
| SCHEMBL587 | 0.89 | ACHE (0.62) | SMN1; SMN2MAPTMEN1KMT2ALMNA | |
| SCHEMBL7412470 | 0.89 | ACHE (0.62) | SMN1; SMN2MAPTMEN1KMT2ALMNA | |
| Formaldehyde SCHEMBL27620752 | 0.86 | ACHE (0.53) | SMN1; SMN2MAPTCES2CES1MEN1 | |
| SCHEMBL27615647 | 0.86 | HPRT1 (0.55) | SMN1; SMN2MAPTCES2CES1MEN1 | |
| SCHEMBL2450704 | 0.86 | ALDH1A1 (0.70) | SMN1; SMN2MAPTCES2CES1MEN1 | |
| Ammonia Solution, Strong SCHEMBL23824902 | 0.86 | ACHE (0.59) | SMN1; SMN2MAPTMEN1KMT2ALMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106349110-A | Two-stage method and one-pot synthesis method for preparing aliphatic diisocyanate | 大东树脂化学股份有限公司 | 2017-01-25 | — | — | CN | disclosed |
| CN-106146832-A | Method for producing aliphatic amine dicarboxylic acid ester, aliphatic amine polycarboxylic acid ester and polyurea using diaryl carbonate | 大东树脂化学股份有限公司 | 2016-11-23 | — | — | CN | disclosed |
| CN-101044109-B | Industrial process for production of high-purity diaryl carbonate | ASAHI CHEMICAL CORP (JP) | 2011-07-06 | — | — | CN | disclosed |
| CN-101044109-A | Industrial process for production of high-purity diaryl carbonate | ASAHI CHEMICAL CORP (JP) | 2007-09-26 | — | — | CN | disclosed |