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 | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | HTR1E | P28566 | 3/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.41 |
| ▸ | CCR3 | P51677 | 1/20 | 0.40 |
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 SCHEMBL3695451 | 0.89 | PTGES (0.47) | PTGESMEN1LMNAKMT2AHTR1E | |
| SCHEMBL1178596 | 0.88 | PTGES (0.43) | PTGESMEN1LMNAKMT2AHTR1E | |
| Bicarbonate SCHEMBL3695595 | 0.86 | PTGES (0.44) | PTGESMEN1LMNAKMT2AHTR1E | |
| SCHEMBL7602752 | 0.86 | PTGES (0.42) | PTGESMEN1LMNAKMT2AHTR1E | |
| Bicarbonate SCHEMBL3693253 | 0.85 | CYP1A2 (0.53) | PTGESMEN1LMNAKMT2AHTR1E | |
| Bicarbonate SCHEMBL16735614 | 0.83 | HTR1E (0.53) | PTGESMEN1LMNAKMT2AHTR1E | |
| Bicarbonate SCHEMBL16735569 | 0.83 | HTR1E (0.53) | PTGESMEN1LMNAKMT2AHTR1E | |
| SCHEMBL1178323 | 0.82 | PTGER3 (0.39) | PTGESMEN1LMNAKMT2AHTR1E | |
| Bicarbonate SCHEMBL3697753 | 0.82 | PTGES (0.46) | PTGESMEN1LMNAKMT2AHTR1E | |
| SCHEMBL7602898 | 0.82 | PTGER3 (0.38) | PTGESMEN1LMNAKMT2AHTR1E |
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-2268625-B1 | OXO-HETEROCYCLIC SUBSTITUTED CARBOXYLIC ACID DERIVATES AND THE USE THEREOF | Bayer Pharma AG (DE) | 2012-05-16 | — | — | EP | disclosed |