Hydrochloric Acid

Hydrochloric Acid

SCHEMBL17698593

CCc1ccc2c(c1)C([Zr+2]C1C(C)=Cc3ccccc31)c1cc(CC)ccc1-2.[Cl-].[Cl-]

nearest known ligand 0.35

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 11)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
MAPK1 P28482 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PDK2 Q15119 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2A6 P11509 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
Hydrochloric Acid SCHEMBL5352100 0.83 ALDH1A1 (0.46) NPC1ALDH1A1LMNAMAPTMAPK1
Hydrochloric Acid SCHEMBL6553652 0.81 GPR3 (0.33) LMNA
Hydrochloric Acid SCHEMBL29565043 0.80 CYP19A1 (0.32)
Hydrochloric Acid SCHEMBL687758 0.80 CYP19A1 (0.32)
Hydrochloric Acid SCHEMBL8857238 0.79 ALDH1A1 (0.35) NPC1ALDH1A1RAB9AL3MBTL1
Hydrochloric Acid SCHEMBL17698617 0.78 CA12 (0.33) NPC1ALDH1A1LMNAMAPTMAPK1
Hydrochloric Acid SCHEMBL17698566 0.77 CYP1A2 (0.38) NPC1ALDH1A1LMNAMAPTMAPK1
Ethylene SCHEMBL5512109 0.76 CYP19A1 (0.30)
Fluoride Ion SCHEMBL1131352 0.76
Bromide SCHEMBL2526728 0.76 HTR2A (0.32) LMNA

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
EP-1473323-B1 Polyethylene composition and process for producing same TOSOH CORP (JP) 2016-04-27 EP disclosed