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 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.38 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | PLA2G2C | Q5R387 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL155435 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL27968514 | 0.84 | — | — | |
| Bicarbonate SCHEMBL10449780 | 0.79 | ALDH1A1 (0.41) | ALDH1A1LMNACA2KDM4ETSHR | |
| Bicarbonate SCHEMBL31496491 | 0.75 | MEN1 (0.41) | ALDH1A1LMNAMAPTCA2L3MBTL1 | |
| Bicarbonate SCHEMBL8455166 | 0.74 | ALDH1A1 (0.50) | ALDH1A1CA2CA9TSHRHPGD | |
| Bicarbonate SCHEMBL9010689 | 0.74 | ABCC4 (0.50) | ALDH1A1LMNAABCC4MAPTCA2 | |
| Acrylic Acid SCHEMBL26134427 | 0.74 | LMNA (0.56) | ALDH1A1LMNATSHRHPGD | |
| SCHEMBL10902293 | 0.74 | — | — | |
| Bicarbonate SCHEMBL7206892 | 0.74 | — | — | |
| SCHEMBL12214046 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3448973-B1 | COMPOSITIONS CONTAINING CARBAMATE FUNCTIONALIZED ORGANOPOLYSILOXANES AND CATIONIC SURFACTANTS | WACKER CHEMIE AG (DE) | 2020-03-04 | — | — | EP | disclosed |
| EP-3448357-B1 | AQUEOUS EMULSION BASED ON CARBAMATO-MODIFIED ORGANOPOLYSILOXANES | WACKER CHEMIE AG (DE) | 2020-02-26 | — | — | EP | disclosed |
| WO-2017186638-A1 | COMPOSITIONS CONTAINING CARBAMATE FUNCTIONALIZED ORGANOPOLYSILOXANES AND CATIONIC SURFACTANTS | WACKER CHEMIE AG (DE) | 2017-11-02 | — | — | WO | disclosed |
| WO-2017186633-A1 | AQUEOUS EMULSIONS OF CARBAMATO-FUNCTIONALIZED ORGANPOLYSILANES | WACKER CHEMIE AG (DE) | 2017-11-02 | — | — | WO | disclosed |