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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | CRHBP | P24387 | 2/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.36 |
| ▸ | REN | P00797 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3681822 | 0.85 | CCR5 (0.36) | ALDH1A1TSHRC5AR1MEN1KMT2A | |
| SCHEMBL3688055 | 0.85 | CCR5 (0.36) | ALDH1A1TSHRC5AR1MEN1KMT2A | |
| SCHEMBL3684186 | 0.82 | CCR2 (0.34) | KDM4EL3MBTL1C5AR1POLB | |
| SCHEMBL3688132 | 0.82 | CCR2 (0.34) | KDM4EL3MBTL1C5AR1POLB | |
| SCHEMBL3683276 | 0.81 | KMT2A (0.36) | ALDH1A1KDM4EL3MBTL1TSHRKMT2A | |
| SCHEMBL3683080 | 0.81 | CMA1 (0.35) | ALDH1A1KDM4EL3MBTL1GAAMEN1 | |
| SCHEMBL3683076 | 0.81 | CMA1 (0.35) | ALDH1A1KDM4EL3MBTL1GAAMEN1 | |
| SCHEMBL3695212 | 0.81 | CMA1 (0.35) | ALDH1A1KDM4EL3MBTL1GAAMEN1 | |
| SCHEMBL3686129 | 0.80 | NPC1 (0.31) | GAAPOLB | |
| SCHEMBL3690102 | 0.79 | CMA1 (0.40) | KDM4EC5AR1GAA |
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-2188277-B1 | QUINAZOLINEDIONE CHYMASE INHIBITORS | BOEHRINGER INGELHEIM INT (DE) | 2012-11-21 | — | — | EP | claimed |