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 | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 2/20 | 0.62 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.62 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | JUN | P05412 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.50 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.50 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL7514670 | 0.92 | CHRNB2 (0.71) | CHRNB2CHRNA4TBXAS1RAB9AMAPT | |
| SCHEMBL7514662 | 0.92 | CHRNB2 (0.71) | CHRNB2CHRNA4TBXAS1RAB9AMAPT | |
| SCHEMBL9519915 | 0.92 | CHRNB2 (0.71) | CHRNB2CHRNA4TBXAS1RAB9AMAPT | |
| SCHEMBL10399145 | 0.87 | CHRNB2 (0.61) | CHRNB2CHRNA4TBXAS1RAB9AMAPT | |
| SCHEMBL4665081 | 0.87 | CHRNB2 (0.61) | CHRNB2CHRNA4TBXAS1RAB9AMAPT | |
| SCHEMBL31506479 | 0.87 | CHRNB2 (0.61) | CHRNB2CHRNA4TBXAS1RAB9AMAPT | |
| SCHEMBL10399144 | 0.87 | CHRNB2 (0.61) | CHRNB2CHRNA4TBXAS1RAB9AMAPT | |
| SCHEMBL4665075 | 0.87 | CHRNB2 (0.61) | CHRNB2CHRNA4TBXAS1RAB9AMAPT | |
| SCHEMBL617910 | 0.83 | CHRNB2 (0.68) | CHRNB2CHRNA4TBXAS1RAB9AMAPT | |
| SCHEMBL3017778 | 0.83 | CHRNB2 (0.68) | CHRNB2CHRNA4TBXAS1RAB9AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0299379-B1 | PENTADIENAMIDE PAF-ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 1993-04-21 | — | — | EP | disclosed |
| EP-0299379-A1 | Pentadienamide PAF-antagonists | F. HOFFMANN-LA ROCHE AG (CH) | 1989-01-18 | — | — | EP | disclosed |