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 | 2/20 | 0.52 |
| ▸ | CHRM1 known ✓ | P11229 | 2/20 | 0.52 |
| ▸ | ACHE known ✓ | P22303 | 2/20 | 0.52 |
| ▸ | SLC6A2 known ✓ | P23975 | 2/20 | 0.52 |
| ▸ | SLC6A3 known ✓ | Q01959 | 2/20 | 0.52 |
| ▸ | CHRM3 known ✓ | P20309 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.60 |
| ▸ | MEN1 | O00255 | 3/20 | 0.60 |
| ▸ | MAPT | P10636 | 3/20 | 0.60 |
| ▸ | TP53 | P04637 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 5/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.58 |
| ▸ | RAD52 | P43351 | 3/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| Bromide SCHEMBL5489286 | 0.96 | KMT2A (0.60) | KMT2AMEN1MAPTTP53CYP1A2 | |
| Hydrochloric Acid SCHEMBL11600265 | 0.92 | MEN1 (0.48) | KMT2AMEN1MAPTTP53CYP1A2 | |
| SCHEMBL8660074 | 0.90 | KMT2A (0.50) | KMT2AMEN1MAPTTP53CYP1A2 | |
| Bromide SCHEMBL8663821 | 0.89 | KMT2A (0.48) | KMT2AMEN1MAPTTP53CYP1A2 | |
| Bromide SCHEMBL8425890 | 0.86 | HDAC8 (0.48) | ACHE | |
| Bromide SCHEMBL8428013 | 0.86 | HDAC8 (0.48) | ACHE | |
| SCHEMBL21350643 | 0.86 | HDAC8 (0.52) | KMT2AMEN1MAPTTP53CYP1A2 | |
| Bromide SCHEMBL8425884 | 0.84 | HDAC8 (0.50) | ACHE | |
| Hydrochloric Acid SCHEMBL2462883 | 0.83 | KMT2A (0.58) | KMT2AMEN1MAPTTP53CYP1A2 | |
| Bromide SCHEMBL9538935 | 0.82 | KMT2A (0.57) | KMT2AMEN1MAPTTP53CYP1A2 |
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-0806473-A2 | Bleach activating cyanopyridinium compounds | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-11-12 | — | — | EP | claimed |
| EP-0806473-A2 | Bleach activating cyanopyridinium compounds | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-11-12 | — | — | EP | disclosed |