Hydrochloric Acid

Hydrochloric Acid

SCHEMBL6404635

Cc1cc(N2CCC(NC(=O)Cn3cc[n+](C)c3)C2)ccc1N.Cc1cc(N2CCC(NC(=O)Cn3cc[n+](C)c3)C2)ccc1N.[Cl-].[Cl-]

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

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 16)

geneUniProtsupporting neighboursconfidence
NAMPT known ✓ P43490 1/20 0.35
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
GAA P10253 1/20 0.38
RAD52 P43351 1/20 0.38
LGMN Q99538 2/20 0.37
SUV39H2 Q9H5I1 5/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PIK3CD O00329 1/20 0.35
F9 P00740 1/20 0.34
ME3 Q16798 1/20 0.34
USP30 Q70CQ3 1/20 0.34
DRD2 P14416 1/20 0.34
DRD3 P35462 1/20 0.34
ACKR3 P25106 2/20 0.34

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.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL2127242 1.00 MTNR1A (0.41) MTNR1AMTNR1BGAARAD52LGMN
SCHEMBL2126032 0.99 MTNR1A (0.41) MTNR1AMTNR1BGAARAD52LGMN
Hydrochloric Acid SCHEMBL2128027 0.88 NAMPT (0.41) MTNR1AMTNR1BLMNASMN1; SMN2NAMPT
SCHEMBL2126877 0.87 NAMPT (0.41) MTNR1AMTNR1BSUV39H2LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL6415215 0.79 GAA (0.46) GAARAD52LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL5707967 0.79 GAA (0.46) GAARAD52LMNASMN1; SMN2
SCHEMBL5707960 0.78 GAA (0.47) GAARAD52LMNASMN1; SMN2
SCHEMBL6152146 0.78 GAA (0.47) GAARAD52LMNASMN1; SMN2
Hydrochloric Acid SCHEMBL5707927 0.76 GAA (0.43) GAARAD52LMNASMN1; SMN2PIK3CD
Hydrochloric Acid SCHEMBL2535075 0.74 GAA (0.38) GAARAD52LGMNSMN1; SMN2

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050257329-A1 Composition for dyeing keratin fibers, comprising at least one alcohol oxidase and at least one cationic oxidation base, and process using this composition L'OREAL S.A. (FR) 2005-11-24 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050257329-A1 Composition for dyeing keratin fibers, comprising at least one alcohol oxidase and at least one cationic oxidation base, and process using this composition KRT18, ADH1C, ADH1A NAMPT 862/4885MTNR1A 3525/4885MTNR1B 3354/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.