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 | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | GABRP | O00591 | 1/20 | 0.48 |
| ▸ | GABRD | O14764 | 1/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.48 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.48 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.48 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.48 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.48 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.48 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.48 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.48 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.48 |
| ▸ | GABRE | P78334 | 1/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.48 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.48 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.48 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.48 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | BTK | Q06187 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL39955 | 0.96 | TSHR (0.46) | TSHRGABRPGABRDGABRA1GABRB1 | |
| Acetic Acid SCHEMBL25244912 | 0.94 | TSHR (0.47) | TSHRGABRPGABRDGABRA1GABRB1 | |
| Methyl Alcohol SCHEMBL28031919 | 0.94 | TSHR (0.45) | TSHRGABRPGABRDGABRA1GABRB1 | |
| Hydrochloric Acid SCHEMBL2310053 | 0.94 | TSHR (0.45) | TSHRGABRPGABRDGABRA1GABRB1 | |
| Hydrochloric Acid SCHEMBL3328736 | 0.92 | TSHR (0.43) | TSHRGABRPGABRDGABRA1GABRB1 | |
| Trifluoroacetic Acid SCHEMBL27039417 | 0.90 | TSHR (0.42) | TSHRGABRPGABRDGABRA1GABRB1 | |
| Acetaldehyde SCHEMBL21114617 | 0.89 | HRH3 (0.41) | TSHRGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL12964597 | 0.89 | SLC6A1 (0.44) | TSHRGABRPGABRDGABRA1GABRB1 | |
| Piperidine SCHEMBL1949563 | 0.89 | HRH3 (0.41) | TSHRGABRPGABRDGABRA1GABRB1 | |
| SCHEMBL1415306 | 0.86 | HRH3 (0.41) | TSHRGABRPGABRDGABRA1GABRB1 |
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-0896580-A1 | SPECIFIC IMMUNOPHILIN LIGANDS AS ANTIASTHMATICS AND IMMUNOSUPPRESSANTS | ASTA Medica Aktiengesellschaft (DE) | 1999-02-17 | — | — | EP | disclosed |
| WO-1997041148-A1 | SPECIFIC IMMUNOPHILIN LIGANDS AS ANTIASTHMATICS AND IMMUNOSUPPRESSANTS | ASTA MEDICA AKTIENGESELLSCHAFT (DE) | 1997-11-06 | — | — | WO | disclosed |