Hydrochloric Acid

Hydrochloric Acid

SCHEMBL28083048

C=C(C)C#N.C=CC(=O)OC(C)C(O)C[N+](C)(C)C.[Cl-]

nearest known ligand 0.37

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 13)

geneUniProtsupporting neighboursconfidence
CHRM2 known ✓ P08172 2/20 0.35
CHRM1 known ✓ P11229 2/20 0.35
CHRM3 known ✓ P20309 1/20 0.31
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
GALR3 O60755 1/20 0.37
BLM P54132 1/20 0.37
TSHR P16473 3/20 0.35
CHRM4 P08173 2/20 0.35
TBXA2R P21731 1/20 0.35
LMNA P02545 3/20 0.33
CHRM5 P08912 1/20 0.31
CYP2C9 P11712 1/20 0.31

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 SCHEMBL27770233 0.89 MAPT (0.42) MAPTSMN1; SMN2GALR3BLMTSHR
SCHEMBL28095366 0.87 TSHR (0.40) MAPTSMN1; SMN2GALR3BLMTSHR
Hydrochloric Acid SCHEMBL1238012 0.71 MAPT (0.60) MAPTSMN1; SMN2GALR3BLMTSHR
Ammonia Solution, Strong SCHEMBL28166132 0.70 TSHR (0.36) TSHR
SCHEMBL2946080 0.69 TSHR (0.59) MAPTSMN1; SMN2GALR3BLMTSHR
SCHEMBL2424095 0.69 TSHR (0.44) SMN1; SMN2TSHR
SCHEMBL3657429 0.69 TSHR (0.44) SMN1; SMN2TSHR
Hydrochloric Acid SCHEMBL27882963 0.68 MAPT (0.39) MAPTSMN1; SMN2GALR3BLMTSHR
SCHEMBL28321811 0.68 TSHR (0.44) TSHR
SCHEMBL12492096 0.68 TSHR (0.47) TSHR

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
CN-105745230-A Radical polymerization initiator and method for producing polymer 日本瑞翁株式会社 2016-07-06 CN disclosed