Hydrochloric Acid

Hydrochloric Acid

SCHEMBL28045741

CCCCc1ccc(C2=Cc3ccccc3C2[Zr+2])c(C)c1.[Cl-].[Cl-]

nearest known ligand 0.40

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
SLC6A2 known ✓ P23975 1/20 0.34
SKP2 Q13309 1/20 0.40
GPR3 P46089 1/20 0.35
PSMB5 P28074 1/20 0.35
CYP3A4 P08684 2/20 0.34
CYP2D6 P10635 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C19 P33261 1/20 0.34
CYP4Z1 Q86W10 1/20 0.34
CYP4F11 Q9HBI6 1/20 0.34
CYP4F12 Q9HCS2 1/20 0.34
DRD2 P14416 1/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
SLC6A4 P31645 1/20 0.34
S1PR1 P21453 1/20 0.33
HSD11B1 P28845 2/20 0.32
RARB P10826 1/20 0.32
NPC1 O15118 2/20 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 SCHEMBL27880512 0.76 ALDH1A1 (0.36) NPC1RAB9ANFKB1NFKB2RELA
Hydrochloric Acid SCHEMBL28553655 0.75 GAA (0.33) DRD2NPC1RAB9ANPSR1SMN1; SMN2
Hydrochloric Acid SCHEMBL8158883 0.75 TLR8 (0.32)
Hydrochloric Acid SCHEMBL8169170 0.75 PSMB5 (0.32) PSMB5
Hydrochloric Acid SCHEMBL6898339 0.72 CYP1A2 (0.41) CYP1A2SMN1; SMN2
Hydrochloric Acid SCHEMBL813276 0.71 CYP3A4 (0.36) CYP3A4CYP2D6CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL5684938 0.71 EDNRB (0.38) HSD11B1
Hydrochloric Acid SCHEMBL4078640 0.69 CYP11B1 (0.31)
Bromide SCHEMBL27932887 0.68 CYP3A4 (0.36) CYP3A4CYP2D6CYP2C9CYP2C19DRD2
Iodide SCHEMBL27948578 0.68 CYP3A4 (0.36) CYP3A4CYP2D6CYP2C9CYP2C19

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-102597096-B Melt blown fiber of polypropylene composition BOREALIS AG (AT) 2015-11-25 CN disclosed