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 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL15225979 | 0.93 | TSHR (0.46) | TSHRPOLBTDP1CTDSP1KDM4E | |
| SCHEMBL8125415 | 0.79 | CHRM5 (0.41) | TSHRPOLBKDM4EALDH1A1LMNA | |
| SCHEMBL30341016 | 0.79 | CHRM5 (0.41) | TSHRPOLBKDM4EALDH1A1LMNA | |
| Bicarbonate SCHEMBL15225793 | 0.78 | ATM (0.44) | TSHRALDH1A1LMNAMAPK1L3MBTL1 | |
| SCHEMBL13013205 | 0.77 | GRM5 (0.39) | TSHRPOLBALDH1A1LMNAMAPK1 | |
| SCHEMBL11888823 | 0.75 | GRM2 (0.43) | TSHRTDP1LMNAMAPK1L3MBTL1 | |
| SCHEMBL3941213 | 0.74 | LMNA (0.48) | TSHRPOLBALDH1A1LMNAMAPK1 | |
| SCHEMBL15226088 | 0.74 | ATM (0.47) | TSHRPOLBALDH1A1LMNAMAPK1 | |
| SCHEMBL27034941 | 0.74 | L3MBTL1 (0.54) | TSHRALDH1A1LMNAMAPK1L3MBTL1 | |
| SCHEMBL14836906 | 0.73 | CA1 (0.42) | TSHRPOLBKDM4EALDH1A1L3MBTL1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1616859-B1 | Substituted cyclohexyl carboxylic acid compounds | SEIKAGAKU KOGYO CO LTD (JP) | 2013-09-04 | — | — | EP | claimed |