Hydrochloric Acid

Hydrochloric Acid

SCHEMBL439809

CC1=C([Zr+2](C2=C(C)C=CC2C)=C(C)c2ccccc2)C(C)C=C1.[Cl-].[Cl-]

nearest known ligand 0.32

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 3)

geneUniProtsupporting neighboursconfidence
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 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 SCHEMBL8858141 0.72 CES2 (0.33)
Hydrochloric Acid SCHEMBL450422 0.66
Hydrochloric Acid SCHEMBL437281 0.65
Hydrochloric Acid SCHEMBL440215 0.62 PDE5A (0.30)
Hydrochloric Acid SCHEMBL436353 0.62
Hydrochloric Acid SCHEMBL6907057 0.62 NFKB1 (0.33) NFKB1NFKB2RELA
Hydrochloric Acid SCHEMBL437960 0.59 MEN1 (0.35)
SCHEMBL15906345 0.58 NFKB1 (0.31) NFKB1NFKB2RELA
Hydrochloric Acid SCHEMBL437014 0.58 CES2 (0.31)
SCHEMBL8157485 0.54 NFKB1 (0.33) NFKB1NFKB2RELA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8841396-B2 Ethylene-α-olefin copolymer and molded article SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-09-23 US disclosed
US-8809462-B2 Ethylene-α-olefin copolymer, molded article, catalyst for copolymerization, and method for producing an ethylene-α-olefin copolymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-19 US disclosed
US-20130005930-A1 ETHYLENE-alpha-OLEFIN COPOLYMER AND MOLDED ARTICLE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-01-03 US disclosed
US-20120065351-A1 ETHYLENE-ALPHA-OLEFIN COPOLYMER AND MOLDED ARTICLE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-03-15 US disclosed
US-20120065346-A1 ETHYLENE-ALPHA-OLEFIN COPOLYMER, MOLDED ARTICLE, CATALYST FOR COPOLYMERIZATION, AND METHOD FOR PRODUCING AN ETHYLENE-ALPHA-OLEFIN COPOLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-03-15 US disclosed