Hydrochloric Acid

Hydrochloric Acid

SCHEMBL978987

CC1=CCC(c2ccc3c(c2[Zr+2]=C(C)C)Cc2ccccc2-3)=C1.[Cl-].[Cl-]

nearest known ligand 0.36

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 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 known ✓ P23975 1/20 0.31
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
PNMT P11086 1/20 0.34
PGR P06401 1/20 0.33
CYP1A2 P05177 1/20 0.31
ADRA2A P08913 1/20 0.31
MAOA P21397 1/20 0.31
HTR2C P28335 1/20 0.31
SLC6A4 P31645 1/20 0.31
HTR2B P41595 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 SCHEMBL5688812 0.85 NPC1 (0.34) NPC1RAB9APNMT
Hydrochloric Acid SCHEMBL617844 0.80 NPC1 (0.37) NPC1RAB9APNMTPGRCYP1A2
Hydrochloric Acid SCHEMBL5087314 0.78 PNMT (0.38) NPC1RAB9APNMTPGR
Fluoride Ion SCHEMBL3469916 0.78 NPC1 (0.37) NPC1RAB9APNMTPGRCYP1A2
SCHEMBL6522771 0.78 NPC1 (0.37) NPC1RAB9APNMTPGRCYP1A2
SCHEMBL5718001 0.77 PNMT (0.39) NPC1RAB9APNMTPGRHTR2B
SCHEMBL8108526 0.77 NPC1 (0.36) NPC1RAB9APNMTPGRCYP1A2
Hydrochloric Acid SCHEMBL978984 0.76 NPC1 (0.36) NPC1RAB9APNMTPGRCYP1A2
Hydrochloric Acid SCHEMBL822337 0.73 NPC1 (0.36) NPC1RAB9APNMTPGRHTR2B
Hydrochloric Acid SCHEMBL5355300 0.70 PGR (0.41) NPC1RAB9APNMTPGRCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5036034-A A syndiospecific polymerization catalyst having non-bilateral symmetry to obtain an amorphous poly-alpha-olefin FINA TECHNOLOGY, INC. (US) 1991-07-30 US claimed
EP-0423101-A2 Catalyst for producing hemiisotactic polypropylene FINA TECHNOLOGY, INC. (US) 1991-04-17 EP claimed
US-8802782-B2 Modified polyolefins with an exceptional profile of properties, process for preparation thereof and use thereof EVONIK DEGUSSA GMBH (DE) 2014-08-12 US disclosed
US-20110003095-A1 MODIFIED POLYOLEFINS WITH AN EXCEPTIONAL PROFILE OF PROPERTIES, PROCESS FOR PREPARATION THEREOF AND USE THEREOF EVONIK DEGUSSA GMBH (DE) 2011-01-06 US disclosed
EP-0423101-B2 Catalyst for producing hemiisotactic polypropylene FINA TECHNOLOGY (US) 2006-05-03 EP disclosed
US-6369175-B1 ACTIVATING METALLOCENE CATALYST WITH METHYLALUMINOXANE; CATALYTIC ADDITION HOMOPOLYMERIZATION; BLENDING WITH SYNDIOTACTIC POLYPROPYLENE; PLASTICIZERS FINA TECHNOLOGY, INC. 2002-04-09 US disclosed
US-6369175-B1 ACTIVATING METALLOCENE CATALYST WITH METHYLALUMINOXANE; CATALYTIC ADDITION HOMOPOLYMERIZATION; BLENDING WITH SYNDIOTACTIC POLYPROPYLENE; PLASTICIZERS FINA TECHNOLOGY, INC. 2002-04-09 US disclosed
EP-0742227-B1 Hemiisotactic polypropylene as a plasticizer for syndiotactic or isotactic polypropylene FINA TECHNOLOGY (US) 2001-03-14 EP disclosed
CN-1058022-C A catalyst for producing hemiisotactic polypropylene FINA TECHNOLOGY (US) 2000-11-01 CN disclosed
EP-0423101-B1 Catalyst for producing hemiisotactic polypropylene FINA TECHNOLOGY (US) 2000-01-26 EP disclosed
EP-0742227-A2 Catalyst for producing hemiisotactic polypropylene and composition containing said hemiostatic polypropylane FINA TECHNOLOGY, INC. (US) 1996-11-13 EP disclosed
EP-0742227-A2 Catalyst for producing hemiisotactic polypropylene and composition containing said hemiostatic polypropylane FINA TECHNOLOGY, INC. (US) 1996-11-13 EP disclosed
CN-1028532-C Catalyst for producing semi-isotactic polypropylene FINA TECHNOLOGY (US) 1995-05-24 CN disclosed
CN-1100733-A A catalyst for producing hemiisotactic polypropylene FINA TECHNOLOGY (US) 1995-03-29 CN disclosed
US-5036034-A A syndiospecific polymerization catalyst having non-bilateral symmetry to obtain an amorphous poly-alpha-olefin FINA TECHNOLOGY, INC. (US) 1991-07-30 US disclosed
US-5036034-A A syndiospecific polymerization catalyst having non-bilateral symmetry to obtain an amorphous poly-alpha-olefin FINA TECHNOLOGY, INC. (US) 1991-07-30 US disclosed
EP-0423101-A2 Catalyst for producing hemiisotactic polypropylene FINA TECHNOLOGY, INC. (US) 1991-04-17 EP disclosed
EP-0423101-A2 Catalyst for producing hemiisotactic polypropylene FINA TECHNOLOGY, INC. (US) 1991-04-17 EP disclosed