Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8959754

CCO[Si](CCC[n+]1ccc(N(Cc2ccccc2)Cc2ccccc2)cc1)(OCC)OCC.[Cl-]

nearest known ligand 0.42

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 20)

geneUniProtsupporting neighboursconfidence
SLC6A3 known ✓ Q01959 2/20 0.37
CHRM2 known ✓ P08172 1/20 0.32
SLC6A2 known ✓ P23975 1/20 0.32
TSHR P16473 4/20 0.42
CYP2C19 P33261 1/20 0.41
LMNA P02545 4/20 0.37
CYP2D6 P10635 2/20 0.37
TAAR1 Q96RJ0 2/20 0.37
ADRA2A P08913 2/20 0.37
ADRA2C P18825 2/20 0.37
ADRA1A P35348 2/20 0.37
HRH1 P35367 2/20 0.37
KCNH2 Q12809 2/20 0.37
CYP1A2 P05177 1/20 0.37
HTR1A P08908 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
PDE6A P16499 1/20 0.37
MC4R P32245 1/20 0.37
OPRM1 P35372 1/20 0.37
DRD3 P35462 1/20 0.37

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 SCHEMBL8959972 0.79 CHKA (0.54) LMNASMN1; SMN2CHKAALDH1A1HTT
SCHEMBL13197528 0.78 CHKA (0.56) LMNASMN1; SMN2CHKAALDH1A1HTT
SCHEMBL21858232 0.75 ACHE (0.48) TSHRLMNAADRA2AADRA2CADRA1A
SCHEMBL13197531 0.73 CHRNA7 (0.35) CYP2C19LMNACYP2D6CYP1A2KMT2A
SCHEMBL4424544 0.73 TSHR (0.39) TSHRLMNATAAR1ADRA2AADRA1A
SCHEMBL24727378 0.72 BCHE (0.43) TSHRADRA2AADRA1ASLC6A3KCNH2
SCHEMBL2207843 0.72 TSHR (0.43) TSHRLMNATAAR1KMT2ASMN1; SMN2
SCHEMBL4425512 0.72 BCHE (0.45) TSHRADRA2AADRA1ASLC6A3KCNH2
SCHEMBL21049526 0.71 SIGMAR1 (0.53) TSHRLMNAOPRM1KMT2AOPRK1
Hydrochloric Acid SCHEMBL9673984 0.70 CHRM2 (0.47) CYP2C19LMNACYP2D6CYP1A2KMT2A

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-0483480-B1 Process for the preparation of organosilanes containing a methacryloxy group or an acryloxy group HUELS CHEMISCHE WERKE AG (DE) 1996-01-31 EP disclosed
US-5117027-A Esterification HULS AKTIENGESELLSCHAFT (DE) 1992-05-26 US disclosed
EP-0483480-A1 Process for the preparation of organosilanes containing a methacryloxy group or an acryloxy group HÜLS AKTIENGESELLSCHAFT (DE) 1992-05-06 EP disclosed