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 | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.32 |
| ▸ | SCN9A | Q15858 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL358921 | 0.97 | SCN10A (0.35) | CYP1A2SCN10ACYP3A4SLC7A5SCN9A | |
| SCHEMBL5101793 | 0.97 | SCN10A (0.35) | CYP1A2SCN10ACYP3A4SLC7A5SCN9A | |
| SCHEMBL43003 | 0.97 | SCN10A (0.35) | CYP1A2SCN10ACYP3A4SLC7A5SCN9A | |
| Hydrochloric Acid SCHEMBL9767617 | 0.95 | SCN10A (0.34) | CYP1A2SCN10ACYP3A4SLC7A5SCN9A | |
| Hydrochloric Acid SCHEMBL9767618 | 0.95 | SCN10A (0.34) | CYP1A2SCN10ACYP3A4SLC7A5SCN9A | |
| Hydrochloric Acid SCHEMBL28902277 | 0.95 | SCN10A (0.34) | CYP1A2SCN10ACYP3A4SLC7A5SCN9A | |
| Hydrochloric Acid SCHEMBL14831325 | 0.95 | SCN10A (0.34) | CYP1A2SCN10ACYP3A4SLC7A5SCN9A | |
| Hydrochloric Acid SCHEMBL6280216 | 0.95 | SCN10A (0.34) | CYP1A2SCN10ACYP3A4SLC7A5SCN9A | |
| Histidine SCHEMBL27646599 | 0.90 | SLC7A5 (0.43) | CYP1A2CYP3A4SLC7A5 | |
| Histidine SCHEMBL4406902 | 0.87 | CYP1A2 (0.47) | CYP1A2CYP3A4SLC7A5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5019647-A | Antigrowth and anticarconogenic hexapeptide | MERCK & CO., INC. (US) | 1991-05-28 | — | — | US | disclosed |
| US-4943561-A | ANTITUMOR | MERCK & CO., INC. (US) | 1990-07-24 | — | — | US | disclosed |
| EP-0371543-A2 | Gastrin releasing peptide antagonists | MERCK & CO. INC. (US) | 1990-06-06 | — | — | EP | disclosed |