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 | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.33 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.32 |
| ▸ | PRKCA | P17252 | 2/20 | 0.32 |
| ▸ | PRKCD | Q05655 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL180145 | 0.94 | CTSK (0.38) | CTSKALDH1A1FFAR3SOAT1PRKCA | |
| SCHEMBL6899777 | 0.84 | TSHR (0.42) | CTSKALDH1A1PRKCAPRKCDCA2 | |
| SCHEMBL14185384 | 0.83 | SOAT1 (0.43) | CTSKALDH1A1FFAR3SOAT1PRKCA | |
| SCHEMBL305036 | 0.83 | CTSK (0.40) | CTSKALDH1A1SOAT1PRKCAPRKCD | |
| Bicarbonate SCHEMBL3240523 | 0.83 | CTSK (0.36) | CTSKFFAR3PRKCAPRKCDMAPK1 | |
| SCHEMBL19018871 | 0.82 | MAPT (0.34) | CTSKALDH1A1PRKCAPRKCDCHRM1 | |
| SCHEMBL21566978 | 0.82 | PRKCA (0.47) | CTSKALDH1A1PRKCAPRKCDMAPK1 | |
| SCHEMBL13704137 | 0.82 | FFAR3 (0.35) | CTSKALDH1A1FFAR3SOAT1 | |
| SCHEMBL5724019 | 0.80 | CTSK (0.33) | CTSK | |
| SCHEMBL6896721 | 0.80 | CTSK (0.33) | CTSK |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1923352-B1 | Negative active material for rechargeable lithium battery, method of preparing the same, and rechargeable lithium battery including the same | SAMSUNG SDI CO LTD (KR) | 2010-06-23 | — | — | EP | disclosed |
| US-20080118841-A1 | NEGATIVE ACTIVE MATERIAL FOR RECHARGEABLE LITHIUM BATTERY, METHOD OF PREPARING THE SAME, AND RECHARGEABLE LITHIUM BATTERY INCLUDING THE SAME | SAMSUNG SDI CO., LTD. (KR) | 2008-05-22 | — | — | US | disclosed |
| EP-1923352-A2 | Negative active material for rechargeable lithium battery, method of preparing the same, and rechargeable lithium battery including the same | Samsung SDI Co., Ltd. (KR) | 2008-05-21 | — | — | EP | disclosed |