Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7601708

CC1=Cc2c(-c3ccc4ccccc4c3)cccc2C1[Zr+2].[Cl-].[Cl-]

nearest known ligand 0.39

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
SLC6A2 known ✓ P23975 1/20 0.37
SLC6A3 known ✓ Q01959 1/20 0.37
GSTP1 P09211 1/20 0.39
HDAC4 P56524 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
SLC6A4 P31645 1/20 0.37
DHFR P00374 1/20 0.35
HSD17B1 P14061 1/20 0.34
HSD17B2 P37059 1/20 0.34
CTSD P07339 1/20 0.34
BACE1 P56817 1/20 0.34
PIM1 P11309 1/20 0.34
MET P08581 1/20 0.34
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 2/20 0.33
AKT1 P31749 1/20 0.33
NPC1 O15118 1/20 0.33
POLB P06746 1/20 0.33

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 SCHEMBL27512112 0.96 GSTP1 (0.36) GSTP1HDAC4HDAC2HDAC8SLC6A2
Hydrochloric Acid SCHEMBL7979475 0.96 GSTP1 (0.35) GSTP1HDAC4HDAC2HDAC8SLC6A2
Hydrochloric Acid SCHEMBL27494608 0.83 GSTP1 (0.36) GSTP1HDAC4HDAC2HDAC8SLC6A2
Hydrochloric Acid SCHEMBL27495381 0.82 PDCD1 (0.33) ALDH1A1
Hydrochloric Acid SCHEMBL29612316 0.82 GSTP1 (0.38) GSTP1HDAC4HDAC2HDAC8SLC6A2
Hydrochloric Acid SCHEMBL5952828 0.82 GSTP1 (0.38) GSTP1HDAC4HDAC2HDAC8SLC6A2
Hydrochloric Acid SCHEMBL5709184 0.82 PDCD1 (0.35) ALDH1A1HPGDHSD17B10CYP2A6
Hydrochloric Acid SCHEMBL29424591 0.82 PDCD1 (0.35) ALDH1A1HPGDHSD17B10CYP2A6
Hydrochloric Acid SCHEMBL3163965 0.82 PDCD1 (0.35) ALDH1A1HPGDHSD17B10CYP2A6
SCHEMBL7940308 0.82 GSTP1 (0.44) GSTP1HDAC4HDAC2HDAC8SLC6A2

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 37 patents — showing the first 20. 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
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-1813009-B Polyethylene wax, lost wax composition for precision casting containing the same, and method for producing mold for precision casting MITSUI CHEMICALS INC 2010-06-02 CN disclosed
CN-101538383-A Lost-wax composition for precision casting and method for making pattern for precision casting MITSUI CHEMICALS INC (JP) 2009-09-23 CN disclosed
CN-101384624-A Catalyst composition for olefin polymerization NOVOLEN TECH HOLDINGS CV (NL) 2009-03-11 CN disclosed
CN-101291977-A Process for producing thermoplastic resin composition MITSUI CHEMICALS INC (JP) 2008-10-22 CN disclosed
CN-101291983-A Process for producing thermoplastic resin composition MITSUI CHEMICALS INC (JP) 2008-10-22 CN disclosed
CN-100415858-C Additive for lubricating oil and lubricating oil composition MITSUI CHEMICALS INC (JP) 2008-09-03 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
CN-1281871-A Flexible resin composition and its use MITSUI CHEMICALS INC (JP) 2001-01-31 CN disclosed
WO-2000022011-A2 SUPPORTED POLYMERIZATION CATALYSTS BOREALIS TECHNOLOGY OY (FI) 2000-04-20 WO disclosed
CN-1246871-A Propylene polymers incorporating polyethylene macromers EXXON CHEMICAL PATENTS INC (US) 2000-03-08 CN disclosed
CN-1217685-A VULCANIZED MOLDING HAVING SURFACE DECORATIVE LAYER, PAINTED THERMOPLASTIC RESIN COMPOSITION AND PAINTED ELASTOMER COMPOSITION MITSUI CHEMICALS INC (JP) 1999-05-26 CN disclosed
CN-1216055-A RUBBER COMPOSITIONS FOR TIRES MITSUI CHEMICALS INC (JP) 1999-05-05 CN disclosed
CN-1216053-A SHRINKABLE FILM MADE FROM OLEFINE COPOLYMER MITSUI CHEMICALS INC (JP) 1999-05-05 CN disclosed
CN-1209827-A 'alpha'-olefin/aromatic vinyl copolymer composition and products thereof MITSUI CHEMICALS INC (JP) 1999-03-03 CN disclosed
US-5840644-A OLEFIN POLYMERIZATION CATALYSTS TARGOR GMBH (DE) 1998-11-24 US disclosed
US-5770753-A ADDITION POLYMERIZATION CATALYST TARGOR GMBH (DE) 1998-06-23 US disclosed