Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8467719

COc1cccc(C2CC3C=CC=CC3C2[Zr+2]C2C(c3cccc(OC)c3)CC3C=CC=CC32)c1.[Cl-].[Cl-]

nearest known ligand 0.46

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
CHRM2 known ✓ P08172 1/20 0.39
CHRM1 known ✓ P11229 1/20 0.39
CHRM3 known ✓ P20309 1/20 0.39
HTR2C P28335 4/20 0.46
HTR2A P28223 2/20 0.46
HTR2B P41595 2/20 0.46
SLC9A1 P19634 1/20 0.43
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
KDM1A O60341 3/20 0.36
MAOA P21397 1/20 0.36
MAOB P27338 1/20 0.36
RCOR1 Q9UKL0 1/20 0.35
ADRA1A P35348 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35

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 SCHEMBL8468856 0.84 KDM1A (0.45) HTR2CMAPTKDM1AMAOAMAOB
SCHEMBL9947171 0.78 HTR2C (0.47) HTR2CHTR2AHTR2BSLC9A1CHRM2
SCHEMBL9947173 0.78 HTR2C (0.50) HTR2CHTR2AHTR2BSLC9A1CHRM2
SCHEMBL9947168 0.76 HTR2C (0.45) HTR2CHTR2AHTR2BSLC9A1CHRM2
Hydrochloric Acid SCHEMBL8468775 0.74 HTR2C (0.43) HTR2CHTR2AHTR2BMAPTADRA1A
SCHEMBL9947172 0.73 HTR2C (0.44) HTR2CHTR2AHTR2BSLC9A1CHRM2
SCHEMBL15763556 0.72 HTR2C (0.41) HTR2CHTR2AHTR2BSLC9A1CHRM2
SCHEMBL8333649 0.72 HTR2C (0.63) HTR2CHTR2AHTR2BSLC9A1CHRM2
Ammonia Solution, Strong SCHEMBL267089 0.71 HTR2C (0.61) HTR2CHTR2AHTR2BSLC9A1CHRM2
SCHEMBL8333645 0.68 HTR2C (0.61) HTR2CHTR2AHTR2BSLC9A1CHRM2

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-0819705-B1 Olefin polymerization PHILLIPS PETROLEUM CO (US) 1999-09-08 EP disclosed