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 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MYC | P01106 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28102000 | 0.93 | HSD17B10 (0.51) | ALDH1A1HPGDCYP1A2CYP2D6HIF1A | |
| SCHEMBL16857585 | 0.83 | LMNA (0.56) | ALDH1A1HPGDCYP1A2CYP2D6HIF1A | |
| SCHEMBL15442859 | 0.77 | MYC (0.55) | ALDH1A1HPGDHSD17B10CA12CA1 | |
| SCHEMBL16857586 | 0.77 | NPC1 (0.71) | HSD17B10TSHRCA12CA1CA2 | |
| SCHEMBL17255701 | 0.77 | HPGD (0.49) | ALDH1A1HPGDCYP1A2CYP2D6HIF1A | |
| SCHEMBL17255699 | 0.77 | HPGD (0.49) | ALDH1A1HPGDCYP1A2CYP2D6HIF1A | |
| SCHEMBL17255717 | 0.75 | NPC1 (0.44) | ALDH1A1HPGDCYP1A2CYP2D6HIF1A | |
| SCHEMBL27920187 | 0.74 | ALDH1A1 (0.46) | ALDH1A1HPGDCYP1A2CYP2D6HIF1A | |
| Bicarbonate SCHEMBL17255684 | 0.74 | KDM4E (0.59) | ALDH1A1HSD17B10TSHRCA12CA1 | |
| SCHEMBL17255673 | 0.74 | PDE4B (0.74) | ALDH1A1CA12CA1CA2CA9 |
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-2669274-B1 | TOPICAL ANTIFUNGAL AGENT | MEIJI SEIKA PHARMA CO LTD (JP) | 2015-11-18 | — | — | EP | claimed |