Hydrochloric Acid

Hydrochloric Acid

SCHEMBL9350965

C=C(C)C(=O)OCC[N+](C)(C)Cc1ccc(C(=O)c2ccccc2)cc1.[Cl-]

nearest known ligand 0.50

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
ACHE known ✓ P22303 1/20 0.38
ELANE P08246 2/20 0.50
HTT P42858 5/20 0.42
POLB P06746 1/20 0.42
APEX1 P27695 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
ALDH1A1 P00352 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPT P10636 2/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ATM Q13315 1/20 0.39
SRD5A2 P31213 1/20 0.38
GAA P10253 2/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 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
SCHEMBL14997833 1.00 ELANE (0.50) ELANEHTTPOLBAPEX1TDP1
Bromide SCHEMBL4904449 0.99 ELANE (0.49) ELANEHTTPOLBAPEX1TDP1
SCHEMBL29201825 0.95 HTT (0.43) ELANEHTTPOLBAPEX1TDP1
SCHEMBL1476595 0.90 MEN1 (0.45) HTTPOLBAPEX1TDP1ALDH1A1
Hydrochloric Acid SCHEMBL166563 0.90 MEN1 (0.45) HTTPOLBAPEX1TDP1ALDH1A1
SCHEMBL14999554 0.89 ELANE (0.52) ELANEHTTPOLBAPEX1TDP1
Hydrochloric Acid SCHEMBL6560373 0.88 POLB (0.54) ELANEHTTPOLBAPEX1TDP1
Bromide SCHEMBL2250534 0.88 MEN1 (0.44) HTTPOLBAPEX1TDP1ALDH1A1
Fluoride Ion SCHEMBL14815797 0.88 MEN1 (0.44) HTTPOLBAPEX1TDP1ALDH1A1
Iodide SCHEMBL2252213 0.88 MEN1 (0.44) HTTPOLBAPEX1TDP1ALDH1A1

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-0333291-B1 Benzophenone derivatives OCTEL CHEM LTD (GB) 1994-08-10 EP disclosed
US-4948819-A Benzophenone quaternary ammonium linked (meth)acrylates, photocurable and photocured products, and method of coating WARD BLENKINSOP & COMPANY LIMITED (GB) 1990-08-14 US disclosed
EP-0333291-A2 Benzophenone derivatives OCTEL CHEMICALS LIMITED (GB) 1989-09-20 EP disclosed