Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5201212

C[n+]1cccc(Cn2ncc(N)c2N)c1.[Cl-]

nearest known ligand 0.48

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
TSHR P16473 2/20 0.48
ALDH1A1 P00352 3/20 0.39
PKM P14618 1/20 0.37
CHRNA7 P36544 1/20 0.34
FDPS P14324 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
RECQL P46063 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
HDAC8 Q9BY41 3/20 0.33
HPGD P15428 1/20 0.32
ALOX15 P16050 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KDM4E B2RXH2 1/20 0.32
NNMT P40261 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL13989331 0.98 TSHR (0.49) TSHRALDH1A1PKMCHRNA7FDPS
Hydrochloric Acid SCHEMBL4863978 0.86 TSHR (0.42) TSHRALDH1A1PKMFDPSNPC1
SCHEMBL13989333 0.81 TSHR (0.49) TSHRALDH1A1PKMNPC1LMNA
SCHEMBL16366778 0.80 TSHR (0.43) TSHRALDH1A1PKMCHRNA7FDPS
Hydrochloric Acid SCHEMBL16325081 0.79 TSHR (0.45) TSHRALDH1A1PKMCHRNA7NPC1
Hydrochloric Acid SCHEMBL16325079 0.79 TSHR (0.45) TSHRALDH1A1PKMCHRNA7NPC1
Hydrochloric Acid SCHEMBL16324344 0.78 TSHR (0.44) TSHRALDH1A1CHRNA7NPC1LMNA
Hydrochloric Acid SCHEMBL16324729 0.78 TSHR (0.47) TSHRALDH1A1PKMCHRNA7LMNA
Hydrochloric Acid SCHEMBL16324731 0.78 TSHR (0.47) TSHRALDH1A1PKMCHRNA7LMNA
SCHEMBL144813 0.77 TSHR (0.69) TSHRALDH1A1RECQLPOLBGAA

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1817379-A2 PYRAZOLE AZOMETHINES AND COLORANTS CONTAINING THESE COMPOUNDS The Procter and Gamble Company (US) 2007-08-15 EP disclosed
US-20070033742-A1 Pyrazole azomethines and colorants containing these compounds PROCTER & GAMBLE COMPANY, THE 2007-02-15 US disclosed
WO-2006060564-A2 PYRAZOLE AZOMETHINES AND COLORANTS CONTAINING THESE COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 2006-06-08 WO disclosed

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-20070033742-A1 Pyrazole azomethines and colorants containing these compounds KRT18, NOX5, TUBB3 TSHR 4767/4885ALDH1A1 193/4885PKM 118/4885

“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.