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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | SLC5A7 | Q9GZV3 | 1/20 | 0.41 |
| ▸ | BBOX1 | O75936 | 7/20 | 0.38 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.35 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.35 |
| ▸ | MMP2 | P08253 | 1/20 | 0.35 |
| ▸ | RAD52 | P43351 | 1/20 | 0.35 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | GALR3 | O60755 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | SLC22A16 | Q86VW1 | 1/20 | 0.31 |
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 SCHEMBL17888821 | 0.92 | MEN1 (0.43) | LMNAMEN1KMT2ACYP3A4SLC5A7 | |
| Acetic Acid SCHEMBL4634983 | 0.89 | CA1 (0.44) | LMNAMEN1KMT2ACYP3A4SLC5A7 | |
| Bicarbonate SCHEMBL8995792 | 0.89 | MEN1 (0.41) | LMNAMEN1KMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL10630113 | 0.83 | LMNA (0.63) | LMNAMEN1KMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL119826 | 0.83 | LMNA (0.63) | LMNAMEN1KMT2ACYP3A4SLC5A7 | |
| Bicarbonate SCHEMBL17888810 | 0.83 | DNM1 (0.46) | LMNAMEN1KMT2ACYP3A4SLC5A7 | |
| SCHEMBL7574661 | 0.82 | LMNA (0.36) | LMNAMEN1KMT2ACYP3A4SLC5A7 | |
| SCHEMBL159367 | 0.82 | MEN1 (0.56) | LMNAMEN1KMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL10630107 | 0.81 | LMNA (0.60) | LMNAMEN1KMT2ACYP3A4SLC5A7 | |
| Choline SCHEMBL8815336 | 0.81 | LMNA (0.60) | LMNAMEN1KMT2ACYP3A4SLC5A7 |
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 |
|---|---|---|---|---|---|---|---|
| US-10449483-B2 | Gas sweetening solvents containing quaternary ammonium salts | DOW GLOBAL TECHNOLOGIES LLC (US) | 2019-10-22 | — | — | US | claimed |
| US-20160206992-A1 | GAS SWEETENING SOLVENTS CONTAINING QUATERNARY AMMONIUM SALTS | DOW GLOBAL TECHNOLOGIES LLC | 2016-07-21 | — | — | US | claimed |
| EP-3038736-A1 | GAS SWEETENING SOLVENTS CONTAINING QUATERNARY AMMONIUM SALTS | Dow Global Technologies LLC (US) | 2016-07-06 | — | — | EP | claimed |
| US-10449483-B2 | Gas sweetening solvents containing quaternary ammonium salts | DOW GLOBAL TECHNOLOGIES LLC (US) | 2019-10-22 | — | — | US | disclosed |
| US-20160206992-A1 | GAS SWEETENING SOLVENTS CONTAINING QUATERNARY AMMONIUM SALTS | DOW GLOBAL TECHNOLOGIES LLC | 2016-07-21 | — | — | US | disclosed |
| EP-3038736-A1 | GAS SWEETENING SOLVENTS CONTAINING QUATERNARY AMMONIUM SALTS | Dow Global Technologies LLC (US) | 2016-07-06 | — | — | EP | disclosed |
| EP-0999206-B1 | Process for producing alpha cyano acetic acid esters | BASF AG (DE) | 2002-09-18 | — | — | EP | disclosed |
| EP-0999206-A1 | Process for producing alpha cyano acetic acid esters | BASF AKTIENGESELLSCHAFT (DE) | 2000-05-10 | — | — | EP | disclosed |
| EP-0671384-B1 | Process for the preparation of 3-cyano-3,5,5,-trimethyl-cyclohexanone | BASF AG (DE) | 1999-11-03 | — | — | EP | disclosed |
| US-5516928-A | REACTION OF ISOPHORONE AND HYDROGEN CYANIDE USING QUATERNARY AMMONIUM CATALYST | BASF AKTIENGESELLSCHAFT (DE) | 1996-05-14 | — | — | US | disclosed |
| EP-0671384-A1 | Process for the preparation of 3-cyano-3,5,5,-trimethyl-cyclohexanone | BASF AKTIENGESELLSCHAFT (DE) | 1995-09-13 | — | — | EP | disclosed |