Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7212489

CC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Hf+](C1C(C)=Cc2c(-c3cccc4ccccc34)cccc21)[GeH](C)C.CC1=Cc2c(-c3cccc4ccccc34)cccc2C1[Hf+](C1C(C)=Cc2c(-c3cccc4ccccc34)cccc21)[GeH](C)C.[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 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA9 Q16790 2/20 0.32
ALDH1A1 P00352 2/20 0.31
CYP2A6 P11509 1/20 0.31
DHFR P00374 1/20 0.31
MAOA P21397 1/20 0.30
MAOB P27338 1/20 0.30
KDM4E B2RXH2 1/20 0.30
TDP2 O95551 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
ALOX12 P18054 1/20 0.30
MAPK1 P28482 1/20 0.30
CASP3 P42574 1/20 0.30
HTT P42858 1/20 0.30
GALK1 P51570 1/20 0.30
BLM P54132 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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 SCHEMBL5854090 0.82 ENPP3 (0.32) CA12CA1CA2CA9ALDH1A1
Hydrochloric Acid SCHEMBL4060835 0.79 ALDH1A1 (0.35) CA12CA1CA2CA9ALDH1A1
SCHEMBL4060837 0.77 CA12 (0.33) CA12CA1CA2CA9ALDH1A1
Hydrochloric Acid SCHEMBL7832824 0.76 CA12 (0.34) CA12CA1CA2CA9ALDH1A1
Hydrochloric Acid SCHEMBL7211657 0.76 CA12 (0.34) CA12CA1CA2CA9ALDH1A1
Hydrochloric Acid SCHEMBL7832821 0.76 KDM4E (0.32) CA12CA1CA2CA9ALDH1A1
Hydrochloric Acid SCHEMBL4094244 0.76 ALDH1A1 (0.35) CA12CA1CA2CA9ALDH1A1
Fluoride Ion SCHEMBL27638222 0.76 ALDH1A1 (0.35) CA12CA1CA2CA9ALDH1A1
Hydrochloric Acid SCHEMBL4068167 0.76 ALDH1A1 (0.35) CA12CA1CA2CA9ALDH1A1
SCHEMBL5860453 0.76 ALDH1A1 (0.37) CA12CA1CA2CA9ALDH1A1

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-6515037-B2 A molded foam using a copolymer of propylene and an alpha-omega diene having been polymerized in the presence of a metallocene supported catalyst and foaming agent; uniform and fine foamed cells; high foaming magnification; extrusion CHISSO CORPORATION (JP) 2003-02-04 US disclosed
US-6337372-B1 ADDITIOIN POLYMERIZATION OF OLEFINS AND PROPYLENE FOR BLOCK POLYMERS CHISSO CORPORATION (JP) 2002-01-08 US disclosed
US-20010031834-A1 Using coordination catalyst; flexibility, elasticity; molding materials CHISSO CORPORATION 2001-10-18 US disclosed
US-20010020045-A1 Polypropylene base resin composition for foam-molding, foamed article using the same composition, production process for the same foamed article and foam-molded product using the foamed-article CHISSO CORPORATION 2001-09-06 US disclosed