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 | |
|---|---|---|---|---|
| ▸ | CHRM2 known ✓ | P08172 | 9/20 | 0.35 |
| ▸ | CHRM3 known ✓ | P20309 | 5/20 | 0.35 |
| ▸ | CHRM1 known ✓ | P11229 | 3/20 | 0.32 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 7/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.31 |
| ▸ | PRKCG | P05129 | 2/20 | 0.31 |
| ▸ | PRKCB | P05771 | 2/20 | 0.31 |
| ▸ | PRKCA | P17252 | 2/20 | 0.31 |
| ▸ | PRKCH | P24723 | 2/20 | 0.31 |
| ▸ | PRKCI | P41743 | 2/20 | 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 SCHEMBL587795 | 0.91 | SLC22A1 (0.41) | SLC22A1ALDH1A1CHRM2CHRM5CHRM3 | |
| SCHEMBL5196667 | 0.89 | SLC22A1 (0.43) | SLC22A1ALDH1A1CHRM2CHRM5CHRM3 | |
| Hydrochloric Acid SCHEMBL7945663 | 0.88 | SLC22A1 (0.42) | SLC22A1ALDH1A1TSHRSMN1; SMN2PRKD3 | |
| Bromide SCHEMBL18260613 | 0.86 | SLC22A1 (0.41) | SLC22A1ALDH1A1CHRM2CHRM5CHRM3 | |
| Iodide SCHEMBL10704645 | 0.86 | CHRM2 (0.42) | SLC22A1ALDH1A1CHRM2CHRM5CHRM3 | |
| Hydrochloric Acid SCHEMBL194217 | 0.86 | CHRM2 (0.40) | ALDH1A1CHRM2CHRM5CHRM3CHRM4 | |
| Hydrochloric Acid SCHEMBL7944279 | 0.86 | DNM1 (0.50) | SLC22A1ALDH1A1TSHRSMN1; SMN2PRKD3 | |
| Hydrochloric Acid SCHEMBL7934749 | 0.84 | DNM1 (0.54) | SLC22A1ALDH1A1TSHRSMN1; SMN2PRKD3 | |
| Hydrochloric Acid SCHEMBL7943566 | 0.84 | DNM1 (0.54) | SLC22A1ALDH1A1TSHRSMN1; SMN2PRKD3 | |
| Hydrochloric Acid SCHEMBL7943643 | 0.84 | DNM1 (0.54) | SLC22A1ALDH1A1TSHRSMN1; SMN2PRKD3 |
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-6251379-B1 | KERATOSE WITH QUATERNARY AMMONIUM SALT AND SILICONE DERIVATIVES | SHISEIDO CO., LTD. (JP) | 2001-06-26 | — | — | US | disclosed |