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 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 2/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | TERT | O14746 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7455224 | 0.92 | ALOX15 (0.55) | TBXAS1ALOX15HRH3KCNH2CYP1A2 | |
| Hydrochloric Acid SCHEMBL28306930 | 0.91 | ALOX15 (0.53) | TBXAS1ALOX15HRH3KCNH2CYP1A2 | |
| Formic Acid SCHEMBL28874959 | 0.90 | ALOX15 (0.46) | TBXAS1ALOX15HRH3KCNH2CYP1A2 | |
| Benzoic Acid SCHEMBL28339203 | 0.88 | ALDH1A1 (0.48) | SIGMAR1OPRM1OPRD1OPRK1ALDH1A1 | |
| SCHEMBL7100019 | 0.83 | ALOX15 (0.51) | TBXAS1ALOX15HRH3KCNH2CYP1A2 | |
| SCHEMBL9866240 | 0.81 | ALOX15 (0.53) | TBXAS1ALOX15HRH3KCNH2TERT | |
| SCHEMBL27278945 | 0.78 | ALOX15 (0.53) | TBXAS1ALOX15KCNH2CYP3A4TERT | |
| SCHEMBL7145906 | 0.76 | ALOX15 (0.51) | TBXAS1ALOX15HRH3KCNH2CYP1A2 | |
| SCHEMBL19827125 | 0.76 | TBXAS1 (0.48) | TBXAS1ALOX15TDP1ALDH1A1KMT2A | |
| SCHEMBL18325377 | 0.75 | ALOX15 (0.81) | ALOX15HRH3KCNH2TDP1ALDH1A1 |
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-110590742-B | N1Long chain alkyl-N3Application of piperidine ethyl imidazole salt | 枣庄学院 | 2022-02-01 | — | — | CN | disclosed |
| CN-110590742-A | N1Long chain alkyl-N3Application of piperidine ethyl imidazole salt | 枣庄学院 | 2019-12-20 | — | — | CN | disclosed |