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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.32 |
| ▸ | KCNN2 | Q9H2S1 | 3/20 | 0.31 |
| ▸ | KCNN3 | Q9UGI6 | 3/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.31 |
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 SCHEMBL6909112 | 0.85 | GABRA1 (0.33) | GABRA1GABRG2GABRB3KCNN2KCNN3 | |
| Hydrochloric Acid SCHEMBL7149371 | 0.82 | GABRA1 (0.33) | GABRA1GABRG2GABRB3KCNN2KCNN3 | |
| Hydrochloric Acid SCHEMBL7764129 | 0.82 | GABRA1 (0.33) | GABRA1GABRG2GABRB3KCNN2KCNN3 | |
| SCHEMBL932704 | 0.81 | GABRA1 (0.35) | KCNH2GABRA1GABRG2GABRB3KCNN2 | |
| SCHEMBL21113715 | 0.81 | BRD4 (0.32) | — | |
| SCHEMBL23644535 | 0.76 | GABRA1 (0.38) | GABRA1GABRG2GABRB3KCNN2KCNN3 | |
| SCHEMBL7927338 | 0.76 | GABRA1 (0.38) | GABRA1GABRG2GABRB3KCNN2KCNN3 | |
| SCHEMBL18543890 | 0.75 | TSHR (0.35) | GABRA1GABRG2GABRB3TSHRFAAH | |
| Hydrochloric Acid SCHEMBL5587654 | 0.75 | GABRA1 (0.43) | GABRA1GABRG2GABRB3KCNN2KCNN3 | |
| SCHEMBL15828371 | 0.75 | GABRA1 (0.43) | GABRA1GABRG2GABRB3KCNN2KCNN3 |
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-1216254-A1 | POLYMERISATION CATALYST | BP Chemicals Limited (GB) | 2002-06-26 | — | — | EP | disclosed |
| WO-2001023396-A1 | POLYMERISATION CATALYST | BP CHEMICALS LIMITED (GB) | 2001-04-05 | — | — | WO | disclosed |