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 | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 2/20 | 0.38 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | CCR3 | P51677 | 3/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | IGF1R | P08069 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
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 SCHEMBL16735630 | 0.94 | ALDH1A1 (0.39) | KMT2AMEN1ALDH1A1LMNAMAPT | |
| Bicarbonate SCHEMBL16735616 | 0.89 | KMT2A (0.41) | KMT2AMEN1LMNAKDM4ECCR3 | |
| Bicarbonate SCHEMBL16735568 | 0.88 | KMT2A (0.39) | KMT2AMEN1ALDH1A1KDM4EGAA | |
| Bicarbonate SCHEMBL9899636 | 0.88 | KMT2A (0.41) | KMT2AMEN1ALDH1A1LMNAMAPT | |
| Bicarbonate SCHEMBL16735635 | 0.87 | KMT2A (0.47) | KMT2AMEN1ALDH1A1LMNAMAPT | |
| SCHEMBL6901415 | 0.85 | LMNA (0.40) | KMT2AMEN1ALDH1A1LMNAMAPT | |
| SCHEMBL1930859 | 0.85 | PPARA (0.43) | KMT2AMEN1ALDH1A1LMNAMAPT | |
| Bicarbonate SCHEMBL16735651 | 0.85 | KMT2A (0.41) | KMT2AMEN1ALDH1A1LMNAMAPT | |
| SCHEMBL10006322 | 0.85 | LMNA (0.39) | KMT2AMEN1ALDH1A1LMNAMAPT | |
| SCHEMBL16749242 | 0.85 | LMNA (0.39) | KMT2AMEN1ALDH1A1LMNAMAPT |
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-2649045-B1 | SUBSTITUTED 1-BENZYLCYCLOALKYLCARBOXLIC ACIDS AND USE THEREOF | BAYER IP GMBH (DE) | 2015-05-27 | — | — | EP | disclosed |