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 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL113972 | 0.92 | MAPK1 (0.44) | HSD17B10MAPK1TP53LMNAMAPT | |
| Acetic Acid SCHEMBL3249560 | 0.92 | MAPK1 (0.44) | HSD17B10MAPK1TP53LMNAMAPT | |
| Acetic Acid SCHEMBL2772542 | 0.92 | MAPK1 (0.44) | HSD17B10MAPK1TP53LMNAMAPT | |
| Acetic Acid SCHEMBL3255637 | 0.92 | MAPK1 (0.44) | HSD17B10MAPK1TP53LMNAMAPT | |
| Lactic Acid SCHEMBL27571251 | 0.90 | TP53 (0.55) | HSD17B10MAPK1TP53LMNAMAPT | |
| SCHEMBL27694487 | 0.90 | HSD17B10 (0.41) | HSD17B10MAPK1TP53LMNAMAPT | |
| Acetic Acid SCHEMBL27775662 | 0.90 | MAPK1 (0.42) | HSD17B10MAPK1TP53LMNAMAPT | |
| Acetone SCHEMBL3316535 | 0.89 | HSD17B10 (0.44) | HSD17B10MAPK1LMNAMAPTTDP1 | |
| SCHEMBL415172 | 0.88 | — | — | |
| SCHEMBL8437357 | 0.88 | HSD17B10 (0.52) | HSD17B10MAPK1LMNAMAPTTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105801388-A | Method for preparing methoxyacetone by oxidizing 1-methoxy-2-propanol with chlorine | 大连信科化工有限公司 | 2016-07-27 | — | — | CN | claimed |