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 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 2/20 | 0.76 |
| ▸ | MEN1 | O00255 | 1/20 | 0.76 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.76 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.76 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.76 |
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 SCHEMBL6685837 | 1.00 | CHRM2 (0.76) | CHRM2MEN1CYP1A2CYP2C19KMT2A | |
| Hydrochloric Acid SCHEMBL6685326 | 1.00 | CHRM2 (0.76) | CHRM2MEN1CYP1A2CYP2C19KMT2A | |
| Hydrochloric Acid SCHEMBL6685485 | 0.99 | CHRM2 (0.74) | CHRM2MEN1CYP1A2CYP2C19KMT2A | |
| SCHEMBL13073061 | 0.87 | CHRM2 (1.00) | CHRM2MEN1CYP1A2CYP2C19KMT2A | |
| Bromide SCHEMBL3989856 | 0.86 | CHRM2 (1.00) | CHRM2MEN1CYP1A2CYP2C19KMT2A | |
| Bromide SCHEMBL9147626 | 0.81 | CHRM2 (0.88) | CHRM2MEN1CYP1A2CYP2C19KMT2A | |
| SCHEMBL12802521 | 0.77 | CHRM2 (0.79) | CHRM2MEN1CYP1A2CYP2C19KMT2A | |
| SCHEMBL9151027 | 0.77 | CHRM2 (0.78) | CHRM2MEN1CYP1A2CYP2C19KMT2A | |
| SCHEMBL12802779 | 0.77 | CHRM2 (0.79) | CHRM2MEN1CYP1A2CYP2C19KMT2A | |
| Bromide SCHEMBL7141283 | 0.76 | CHRM2 (0.80) | CHRM2MEN1CYP1A2CYP2C19KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004056836-A1 | SILICON-CONTAINING COMPOUNDS AND THEIR USE | AMEDIS PHARMACEUTICALS LTD. (GB) | 2004-07-08 | — | — | WO | claimed |
| WO-2004056836-A1 | SILICON-CONTAINING COMPOUNDS AND THEIR USE | AMEDIS PHARMACEUTICALS LTD. (GB) | 2004-07-08 | — | — | WO | disclosed |