Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7065728

Cc1cccc2c1C=C(c1ccco1)C2[Zr+2]C1C(c2ccco2)=Cc2c(C)cccc21.[Cl-].[Cl-]

nearest known ligand 0.34

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 7)

geneUniProtsupporting neighboursconfidence
CHRM2 known ✓ P08172 1/20 0.31
CHRM1 known ✓ P11229 1/20 0.31
CHRM3 known ✓ P20309 1/20 0.31
ALDH1A1 P00352 1/20 0.34
CHRM4 P08173 1/20 0.31
CHRM5 P08912 1/20 0.31
S1PR4 O95977 1/20 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 SCHEMBL30312734 0.82 PTGS1 (0.39) ALDH1A1
Hydrochloric Acid SCHEMBL7722394 0.80 ALDH1A1 (0.34) ALDH1A1CHRM2CHRM4CHRM5CHRM1
Hydrochloric Acid SCHEMBL7731186 0.80 ALDH1A1 (0.34) ALDH1A1CHRM2CHRM4CHRM5CHRM1
Hydrochloric Acid SCHEMBL3669142 0.80 SMARCA2 (0.35) ALDH1A1
Hydrochloric Acid SCHEMBL7063803 0.78 ALDH1A1 (0.39) ALDH1A1
Hydrochloric Acid SCHEMBL3671702 0.77 CHRM2 (0.35) ALDH1A1CHRM2CHRM4CHRM5CHRM1
Hydrochloric Acid SCHEMBL7061934 0.77 KDM4E (0.33) ALDH1A1
SCHEMBL7731189 0.76 ALDH1A1 (0.31) ALDH1A1CHRM2CHRM4CHRM5CHRM1
SCHEMBL7722398 0.76 ALDH1A1 (0.31) ALDH1A1CHRM2CHRM4CHRM5CHRM1
SCHEMBL7065731 0.76 ALDH1A1 (0.31) ALDH1A1CHRM2CHRM4CHRM5CHRM1

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
US-6635733-B2 Coordination catalyst; radiation transparent, elasticity CHISSO CORPORATION (JP) 2003-10-21 US disclosed
US-6479646-B1 Metallocene compounds having indenyl ligand and catalysts for olefin polymerization containing the same CHISSO CORPORATION (JP) 2002-11-12 US disclosed
US-20020002261-A1 Elastomeric polypropylene JNC PETROCHEMICAL CORPORATION (JP) 2002-01-03 US disclosed
US-20010031834-A1 Using coordination catalyst; flexibility, elasticity; molding materials CHISSO CORPORATION 2001-10-18 US disclosed