Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4556847

CC1=Cc2c(-c3ccc(C(F)(F)F)cc3)cccc2C1[Zr+2].[Cl-].[Cl-]

nearest known ligand 0.35

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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
KIF11 P52732 3/20 0.35
ENPP1 P22413 1/20 0.34
JAK2 O60674 1/20 0.34
DRD2 P14416 1/20 0.34
APP P05067 1/20 0.33
KDR P35968 1/20 0.32
BACE1 P56817 2/20 0.32
TOP1 P11387 1/20 0.32
MAPT P10636 1/20 0.32
CYP11B1 P15538 2/20 0.32
CYP11B2 P19099 2/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
PARP1 P09874 1/20 0.32
PARP2 Q9UGN5 1/20 0.32
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31
GABBR2 O75899 1/20 0.31
GABBR1 Q9UBS5 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 SCHEMBL31571607 0.89
Hydrochloric Acid SCHEMBL7203230 0.87 KIF11 (0.34) KIF11RAB9ASMN1; SMN2PARP1
Hydrochloric Acid SCHEMBL29612278 0.87 KIF11 (0.34) KIF11RAB9ASMN1; SMN2PARP1
Hydrochloric Acid SCHEMBL27407010 0.86 HTR1A (0.39) RAB9APARP1MAOB
SCHEMBL30621324 0.84 BRD4 (0.34) KIF11RAB9ASMN1; SMN2
Hydrochloric Acid SCHEMBL27513156 0.84 HTR2C (0.35) KDRCYP11B2
Hydrochloric Acid SCHEMBL6889130 0.84 SYK (0.33) MAPTRAB9A
Hydrochloric Acid SCHEMBL27670339 0.83 DRD2 (0.39) KIF11ENPP1JAK2DRD2KDR
Hydrochloric Acid SCHEMBL27495381 0.82 PDCD1 (0.33)
Hydrochloric Acid SCHEMBL7934283 0.82 MAOA (0.32) JAK2KDRRAB9ASMN1; SMN2MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1946748-B Metallocene ligands, metallocene compounds and metallocene catalysts, their synthesis and their use for the polymerization of olefins NOVOLEN TECH HOLDINGS CV 2011-04-06 CN claimed
US-7618912-B2 Preparation of supported catalyst systems BASELL POLYOLEFINE GMBH (DE) 2009-11-17 US claimed
CN-1946748-A Metallocene ligands, metallocene compounds and metallocene catalysts, their synthesis and their use for the polymerization of olefins NOVOLEN TECH HOLDINGS CV (NL) 2007-04-11 CN claimed
CN-101384624-B Catalyst composition for olefin polymerization NOVOLEN TECH HOLDINGS CV 2012-07-04 CN disclosed
CN-1946748-B Metallocene ligands, metallocene compounds and metallocene catalysts, their synthesis and their use for the polymerization of olefins NOVOLEN TECH HOLDINGS CV 2011-04-06 CN disclosed
CN-101384624-A Catalyst composition for olefin polymerization NOVOLEN TECH HOLDINGS CV (NL) 2009-03-11 CN disclosed
CN-1946748-A Metallocene ligands, metallocene compounds and metallocene catalysts, their synthesis and their use for the polymerization of olefins NOVOLEN TECH HOLDINGS CV (NL) 2007-04-11 CN disclosed
EP-1263847-A1 PROCESS FOR THE PREPARATION OF ADDITIVE COATED MOLDING POWDER Borealis Technology Oy (FI) 2002-12-11 EP disclosed
WO-2001062832-A1 PROCESS FOR THE PREPARATION OF ADDITIVE COATED MOLDING POWDER BOREALIS TECHNOLOGY OY (FI) 2001-08-30 WO disclosed
EP-1123319-A2 SUPPORTED POLYMERIZATION CATALYSTS Borealis Technology (FI) 2001-08-16 EP disclosed
WO-2000022011-A2 SUPPORTED POLYMERIZATION CATALYSTS BOREALIS TECHNOLOGY OY (FI) 2000-04-20 WO disclosed