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 | |
|---|---|---|---|---|
| ▸ | BBOX1 | O75936 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | KCNA1 | Q09470 | 1/20 | 0.35 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | SLC5A7 | Q9GZV3 | 1/20 | 0.33 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 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 SCHEMBL8857321 | 0.97 | BBOX1 (0.35) | BBOX1TSHRNFKB1KCNA1DNM1 | |
| Bicarbonate SCHEMBL8410024 | 0.92 | BBOX1 (0.35) | BBOX1TSHRNFKB1KCNA1DNM1 | |
| Acetic Acid SCHEMBL320127 | 0.92 | CA1 (0.40) | BBOX1TSHRNFKB1KCNA1DNM1 | |
| Bicarbonate SCHEMBL8857423 | 0.86 | TSHR (0.37) | TSHRNFKB1KCNA1DNM1MEN1 | |
| Fumaric Acid SCHEMBL2353231 | 0.86 | CA1 (0.40) | BBOX1DNM1 | |
| Fumaric Acid SCHEMBL2353238 | 0.86 | CA1 (0.40) | BBOX1DNM1 | |
| Fumaric Acid SCHEMBL2355570 | 0.86 | CA1 (0.40) | BBOX1DNM1 | |
| SCHEMBL476985 | 0.86 | TSHR (0.47) | TSHRNFKB1KCNA1DNM1MEN1 | |
| Acrylic Acid SCHEMBL2354037 | 0.84 | TSHR (0.34) | BBOX1TSHR | |
| Methacrylic Acid SCHEMBL2351340 | 0.84 | BBOX1 (0.31) | BBOX1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5693599-A | Flux washing agent | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1997-12-02 | — | — | US | claimed |
| JP-11050285-A | — | — | None | — | — | JP | disclosed |
| JP-H1150285-A | PRODUCTION OF HIGH-PURITY BETA-HYDROXYETHYLTRIETHYL AMMONIUM HYDROXIDE | NIPPON HIDORAJIN KOGYO KK | 1999-02-23 | — | — | JP | disclosed |
| US-5693599-A | Flux washing agent | MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) | 1997-12-02 | — | — | US | disclosed |