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 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL735183 | 0.96 | ALDH1A1 (0.41) | ALDH1A1THRBTSHRTDP1 | |
| Chloromethane SCHEMBL253218 | 0.94 | ALDH1A1 (0.39) | ALDH1A1THRBTSHRTDP1 | |
| Acrylamide SCHEMBL11512778 | 0.85 | ALDH1A1 (0.38) | ALDH1A1THRBTSHRTDP1 | |
| Sulfuric Acid Dimethyl Ester SCHEMBL7646730 | 0.84 | ALDH1A1 (0.36) | ALDH1A1TSHR | |
| SCHEMBL27605411 | 0.80 | ALDH1A1 (0.43) | ALDH1A1THRBTSHRTDP1 | |
| SCHEMBL22353268 | 0.79 | ALDH1A1 (0.44) | ALDH1A1THRBTSHRTDP1 | |
| SCHEMBL1067047 | 0.79 | ALDH1A1 (0.44) | ALDH1A1THRBTSHRTDP1 | |
| SCHEMBL8084623 | 0.78 | ELANE (0.36) | ALDH1A1TDP1 | |
| SCHEMBL347723 | 0.77 | ALDH1A1 (0.42) | ALDH1A1THRBTSHRTDP1 | |
| SCHEMBL21496027 | 0.77 | ALDH1A1 (0.42) | ALDH1A1THRBTSHRTDP1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8092854-B2 | Method of attaching an antimicrobial cationic polyelectrolyte to the surface of a substrate | QUICK-MED TECHNOLOGIES, INC. (US) | 2012-01-10 | — | — | US | disclosed |