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 | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 5/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.53 |
| ▸ | GALR3 | O60755 | 1/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.44 |
| ▸ | RELA | Q04206 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | PTPRC | P08575 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | RXRA | P19793 | 1/20 | 0.42 |
| ▸ | RXRB | P28702 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14200248 | 0.92 | HTT (0.55) | HTTKMT2ASMN1; SMN2MEN1GALR3 | |
| SCHEMBL9605456 | 0.87 | HTT (0.55) | HTTKMT2ASMN1; SMN2MEN1GALR3 | |
| SCHEMBL13343341 | 0.82 | TSHR (0.47) | HTTKMT2ASMN1; SMN2MEN1GALR3 | |
| SCHEMBL28876836 | 0.82 | ALDH1A1 (0.53) | HTTKMT2ASMN1; SMN2MEN1GALR3 | |
| SCHEMBL26629030 | 0.80 | TSHR (0.65) | HTTKMT2ASMN1; SMN2MEN1GALR3 | |
| SCHEMBL16953463 | 0.79 | SMN1; SMN2 (0.49) | HTTKMT2ASMN1; SMN2MEN1GALR3 | |
| SCHEMBL23113747 | 0.78 | HTT (0.47) | HTTKMT2ASMN1; SMN2MEN1GALR3 | |
| SCHEMBL16951829 | 0.78 | HTT (0.47) | HTTKMT2ASMN1; SMN2MEN1GALR3 | |
| SCHEMBL12283513 | 0.78 | MEN1 (0.47) | HTTKMT2ASMN1; SMN2MEN1GALR3 | |
| SCHEMBL13155130 | 0.78 | HTT (0.47) | HTTKMT2ASMN1; SMN2MEN1GALR3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109803962-A | Modulators of cystic fibrosis transmembrane conductance regulator proteins, pharmaceutical compositions, methods of treatment, and methods for making the modulators | 弗特克斯药品有限公司 | 2019-05-24 | — | — | CN | disclosed |
| CN-103641765-B | ATP-combines the adjusting control agent of cassette transporters | 沃泰克斯药物股份有限公司 | 2016-08-17 | — | — | CN | disclosed |