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 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA7 | P43166 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | MAP3K14 | Q99558 | 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 SCHEMBL9440560 | 0.76 | ALDH1A1 (0.34) | ALDH1A1TRPA1CYP1A2CYP2A6CA1 | |
| SCHEMBL8765533 | 0.75 | ALDH1A1 (0.37) | ALDH1A1TRPA1CYP1A2CYP2A6CA1 | |
| Hydrochloric Acid SCHEMBL16144817 | 0.74 | ALDH1A1 (0.33) | ALDH1A1TRPA1CYP1A2CYP2A6 | |
| Hydrochloric Acid SCHEMBL7548477 | 0.74 | ALDH1A1 (0.33) | ALDH1A1TRPA1CYP1A2CYP2A6 | |
| SCHEMBL2976928 | 0.72 | ALDH1A1 (0.39) | ALDH1A1TRPA1CYP1A2CYP2A6CA1 | |
| Hydrochloric Acid SCHEMBL6939971 | 0.72 | ALDH1A1 (0.34) | ALDH1A1TRPA1CYP1A2CYP2A6CA1 | |
| SCHEMBL2976924 | 0.72 | ALDH1A1 (0.39) | ALDH1A1TRPA1CYP1A2CYP2A6CA1 | |
| SCHEMBL2976926 | 0.72 | ALDH1A1 (0.39) | ALDH1A1TRPA1CYP1A2CYP2A6CA1 | |
| SCHEMBL4612438 | 0.72 | ALDH1A1 (0.34) | ALDH1A1TRPA1CYP1A2CYP2A6CA1 | |
| SCHEMBL28330121 | 0.72 | ALDH1A1 (0.34) | ALDH1A1TRPA1CYP1A2CYP2A6CA1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1049899-C | Process for the preparation of a bridged metallocene compound as well as a catalyst component and a process for the polymerization of olefins | DSM NV (NL) | 2000-03-01 | — | — | CN | disclosed |
| EP-0906914-A2 | Solid aluminoxane for catalyst carrier, process for preparing the same, and uses thereof | Mitsui Chemicals, Inc. (JP) | 1999-04-07 | — | — | EP | disclosed |
| CN-1128272-A | Process for the preparation of a bridged metallocene compound as well as a catalyst component and a process for the polymerization of olefins | DSM NV (NL) | 1996-08-07 | — | — | CN | disclosed |
| CN-1031278-C | Modified polyolefin particles and process for preparation thereof | MITSUI PETROCHEMICAL IND (JP) | 1996-03-13 | — | — | CN | disclosed |
| EP-0287666-A1 | PROCESS FOR POLYMERIZING OLEFINS | Mitsui Chemicals, Inc. (JP) | 1988-10-26 | — | — | EP | disclosed |