Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Hydrochloric Acid. 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 | |
|---|---|---|---|---|
| ▸ | PAX8 | Q06710 | 1/20 | 0.38 |
| ▸ | CHKA | P35790 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | GLA | P06280 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6584613 | 0.80 | PAX8 (0.41) | PAX8POLBALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL16926988 | 0.69 | PAX8 (0.47) | PAX8POLBALDH1A1MEN1KMT2A | |
| SCHEMBL1006428 | 0.67 | PAX8 (0.63) | PAX8POLBALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL16926987 | 0.66 | PAX8 (0.47) | PAX8POLBALDH1A1MEN1KMT2A | |
| SCHEMBL24262518 | 0.65 | KMT2A (0.61) | PAX8POLBALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL6051643 | 0.64 | POLB (0.48) | PAX8POLBALDH1A1MEN1KMT2A | |
| SCHEMBL2232138 | 0.62 | PAX8 (0.58) | PAX8POLBALDH1A1MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL6051717 | 0.61 | POLB (0.45) | PAX8POLBALDH1A1MEN1KMT2A | |
| SCHEMBL16731209 | 0.60 | CHKA (0.59) | CHKA | |
| SCHEMBL26373155 | 0.60 | PAX8 (0.55) | PAX8POLBALDH1A1MEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1085000-B1 | PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE AND CONDENSING AGENT COMPRISING QUATERNARY AMMONIUM SALT | TOKUYAMA CORP (JP) | 2004-10-06 | — | — | EP | disclosed |
| US-6458948-B1 | MIXING A QUATERNARY AMMONIUM SALT HAVING A PARTICULAR TRIAZINE RING IN THE MOLECULES THEREOF, A CARBOXYLIC ACID COMPOUND AND A COMPOUND HAVING A NUCLEOPHILIC FUNCTIONAL GROUP, TO CONDENSE THE CARBOXYLIC ACID WITH THE COMPOUND HAVING THE NUCLEOPHILIC | TOKUYAMA CORPORATION (JP) | 2002-10-01 | — | — | US | disclosed |
| EP-1085000-A1 | PROCESS FOR PRODUCING CARBOXYLIC ACID DERIVATIVE AND CONDENSING AGENT COMPRISING QUATERNARY AMMONIUM SALT | TOKUYAMA CORPORATION (JP) | 2001-03-21 | — | — | EP | disclosed |