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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | GBA1 | P04062 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4655299 | 0.92 | MAPT (0.66) | MAPTTDP1SMN1; SMN2ALDH1A1CYP1A2 | |
| SCHEMBL11277564 | 0.81 | MAPT (0.52) | MAPTTDP1SMN1; SMN2ALDH1A1CYP1A2 | |
| SCHEMBL27749945 | 0.81 | MAPT (0.53) | MAPTTDP1SMN1; SMN2ALDH1A1CYP1A2 | |
| SCHEMBL11174447 | 0.75 | MAPT (0.50) | MAPTTDP1SMN1; SMN2ALDH1A1 | |
| SCHEMBL30683721 | 0.75 | MAPT (0.50) | MAPTTDP1SMN1; SMN2ALDH1A1 | |
| SCHEMBL2082827 | 0.73 | MAPT (1.00) | MAPTTDP1SMN1; SMN2ALDH1A1CYP1A2 | |
| SCHEMBL8155209 | 0.73 | MAPT (0.61) | MAPTTDP1SMN1; SMN2ALDH1A1 | |
| SCHEMBL10896316 | 0.73 | MAPT (1.00) | MAPTTDP1SMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL4153725 | 0.73 | MAPT (0.61) | MAPTTDP1SMN1; SMN2ALDH1A1CYP1A2 | |
| SCHEMBL8923934 | 0.71 | CHRNB2 (0.56) | MAPTTDP1SMN1; SMN2ALDH1A1CYP1A2 |
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-0243734-B1 | OPTICALLY ACTIVE HYDANTOIN | MERCK PATENT GmbH (DE) | 1991-07-17 | — | — | EP | disclosed |
| EP-0243734-A2 | Optically active hydantoin | MERCK PATENT GmbH (DE) | 1987-11-04 | — | — | EP | disclosed |