Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4188748

CCCCCCCCCCCCCCCCCC[N+](CCCCCCCCCCCCCCCCCC)(Cc1ccccc1C)Cc1ccccc1C.[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 18)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.41
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
TP53 P04637 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 2/20 0.46
SLC22A1 O15245 2/20 0.45
DNM1 Q05193 6/20 0.45
ALDH1A1 P00352 1/20 0.43
CYP3A4 P08684 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
ALOX12 P18054 1/20 0.43
HIF1A Q16665 1/20 0.43
HSD17B10 Q99714 1/20 0.43
SLC22A2 O15244 1/20 0.41
BCHE P06276 1/20 0.41

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 SCHEMBL4193707 0.97 SMN1; SMN2 (0.47) MEN1KMT2ATP53SMN1; SMN2MAPK1
SCHEMBL26137982 0.86 DNM1 (0.40) MEN1KMT2ATP53SMN1; SMN2MAPK1
SCHEMBL26138010 0.86 DNM1 (0.40) MEN1KMT2ATP53SMN1; SMN2MAPK1
SCHEMBL26138012 0.85 BCHE (0.39) MEN1KMT2ATP53SMN1; SMN2MAPK1
SCHEMBL26138011 0.85 DNM1 (0.39) MEN1KMT2ATP53SMN1; SMN2MAPK1
Hydrochloric Acid SCHEMBL6574042 0.79 DNM1 (0.50) MEN1KMT2ATP53SMN1; SMN2MAPK1
Hydrochloric Acid SCHEMBL20520489 0.77 TAAR1 (0.43) MEN1KMT2ASMN1; SMN2HTTCYP3A4
Tetrabuthylammonium SCHEMBL5470043 0.77 SLC22A1 (0.57) MEN1KMT2ATP53SMN1; SMN2MAPK1
Hydrochloric Acid SCHEMBL2059991 0.77 MEN1 (0.71) MEN1KMT2ATP53SMN1; SMN2MAPK1
Hydrochloric Acid SCHEMBL5086997 0.77 MEN1 (0.71) MEN1KMT2ATP53SMN1; SMN2MAPK1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1312918-B1 Oxygen detecting composition MITSUBISHI GAS CHEMICAL CO (JP) 2009-02-18 EP disclosed
US-6703245-B2 Oxygen detecting composition MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2004-03-09 US disclosed
EP-1312918-A2 Oxygen detecting composition MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2003-05-21 EP disclosed
US-20030082823-A1 Oxygen detecting composition MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2003-05-01 US disclosed