Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5155938

CC1=Cc2c(C(C)C)cc(C(C)C)cc2C1[Zr](C)([SiH2]c1ccccc1)C1C(C)=Cc2c(C(C)C)cc(C(C)C)cc21.Cl.Cl

nearest known ligand 0.00

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ACEACHEACVR1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3AGTR1ALKAVPR1AAVPR2BCHEBCRCA2CACNA1ACACNA1BCACNA1CCACNA1DCACNA1ECACNA1FCACNA1GCACNA1HCACNA1ICACNA1SCACNA2D1CACNA2D2CACNA2D3CACNA2D4CACNB1CACNB2CACNB3CACNB4CACNG1CACNG2CACNG3CACNG4CACNG5CACNG6CACNG7CACNG8CALCRLCASRCCR5CDK4CDK6CFBCHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNA3CHRNA7CHRNB1CHRNB4CHRNDCHRNECHRNGCOXFA4COXFA4L2CRBNCSF1RCUL4ACYP19A1DDB1DPP4DRD1DRD2DRD3DRD4EDNRAEGFREML4ERBB2ERBB4ESR1ESR2FGFR1FGFR3FLT1FLT3FLT4GAAGABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGHSRGLAGNRHRGPD2GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSTP1HCN4HCRTR1HCRTR2HDAC1HDAC10HDAC11HDAC2HDAC3HDAC4HDAC5HDAC6HDAC7HDAC8HDAC9HRH1HRH2HRH3HSD11B1HSP90AA1HSP90AB1HTR1AHTR1BHTR1DHTR1EHTR1FHTR2AHTR2BHTR2CHTR3AHTR3BHTR3CHTR3DHTR3EHTR4HTR5AHTR6HTR7IMPDH1IMPDH2ITGA2BITGB3ITKJAK1JAK2KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNJ2KCNJ3KCNJ5KCNK3KCNK9KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2KDRKITKLKB1LCKMMAOAMAOBMAPK14METMMP1MMP13MMP7MMP8MT-ND1MT-ND2MT-ND3MT-ND4MT-ND4LMT-ND5MT-ND6NDUFA1NDUFA10NDUFA11NDUFA12NDUFA13NDUFA2NDUFA3NDUFA5NDUFA6NDUFA7NDUFA8NDUFA9NDUFAB1NDUFAF1NDUFAF2NDUFAF3NDUFAF4NDUFB1NDUFB10NDUFB11NDUFB2NDUFB3NDUFB4NDUFB5NDUFB6NDUFB7NDUFB8NDUFB9NDUFC1NDUFC2NDUFS1NDUFS2NDUFS3NDUFS4NDUFS5NDUFS6NDUFS7NDUFS8NDUFV1NDUFV2NDUFV3NR3C1NS5ANTRK1NTRK2NTRK3ODC1OPRD1OPRK1OPRM1P2RY12PAHPARP1PDE3APDE3BPDE4APDE4BPDE4CPDE4DPDE5APDE7APDE7BPDE8APDE8BPDGFRAPDGFRBPIK3CAPIK3CDPNPPOLA1POLA2POLD1POLD2POLD3POLD4POLEPOLE2POLE3PPARGPRIM1PRIM2PRKCAPRKCBPRKCDPRKCEPRKCGPRKCHPRKCIPRKCQPRKCZPRKD1PRKD3PTGS1PTGS2RBX1RENRETROCK1ROCK2RPE65RRM1RRM2RRM2BS1PR1S1PR2S1PR3S1PR4S1PR5SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASCNN1ASCNN1BSCNN1GSIGMAR1SLC18A2SLC6A1SLC6A2SLC6A3SLC6A4SLC9A3SRCTACR1TOP1TOP2ATOP2BTTRTYMPdacAdacBdacCembAfolAftsIgyrAgyrBmrcAmrcBmrdAparCparEpolrplArplBrplCrplDrplErplFrplIrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmE2rpmFrpmGrpmG1rpmG2rpmG3rpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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.

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL8505801 0.99
Hydrochloric Acid SCHEMBL6520957 0.78
SCHEMBL8823401 0.78 FABP3 (0.32)
SCHEMBL27599222 0.78 GABRA1 (0.33)
Ethane SCHEMBL8629727 0.76 GABRA1 (0.30)
SCHEMBL7604239 0.74 GABRA1 (0.31)
SCHEMBL7636419 0.74 GABRA1 (0.36)
SCHEMBL7643031 0.74 GABRA1 (0.33)
SCHEMBL2111099 0.74 GABRA1 (0.33)
Propane SCHEMBL8628909 0.74

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5914376-A Catalyst for the polymerization of olefins, process for the preparation thereof, and use thereof TARGOR GMBH (DE) 1999-06-22 US claimed
EP-0876405-B2 OLEFIN POLYMERIZATION CATALYST SYSTEM, PRODUCING AND USING IT BOREALIS AS (DK) 2007-01-03 EP disclosed
US-6747077-B2 HINDERED AMINE CIBA SPECIALTY CHEMICALS CORPORATION 2004-06-08 US disclosed
US-6512029-B1 Stabilized metallocene polyolefins CIBA SPECIALTY CHEMICALS CORPORATION 2003-01-28 US disclosed
US-20020128406-A1 PROCESS FOR POLYMERIZING UNSATURATED POLYALKYLPIPERIDINES WILEN CARL-ERIC MAGNUS (FI) 2002-09-12 US disclosed
US-20020077394-A1 Stabilized metallocene polypropylene CIBA SPECIALTY CHEMICALS CORP. 2002-06-20 US disclosed
US-20020013217-A1 CATALYST FOR THE POLYMERIZATION OF OLEFINS, PROCESS FOR ITS PREPARATION AND ITS USE HANS-FRIEDRICH HERRMANN 2002-01-31 US disclosed
US-6225423-B1 AS POLYMERIZATION CATALYST USED IN OLEFIN POLYMERIZATION BOREALIS TECHNOLGY OY (FI) 2001-05-01 US disclosed
US-6051522-A Catalyst which can be used for the preparation of olefins during polymerization TARGOR GMBH (DE) 2000-04-18 US disclosed
EP-0876405-B1 OLEFIN POLYMERIZATION CATALYST SYSTEM, PRODUCING AND USING IT BOREALIS AS (DK) 2000-03-15 EP disclosed
US-5852142-A Process for the preparation of an olefin polymer TARGOR GMBH (DE) 1998-12-22 US disclosed
US-5840948-A Process for the preparation of substituted indenes and their use as ligand systems for metallocene catalysts TARGOR GMBH (DE) 1998-11-24 US disclosed
EP-0876405-A1 OLEFIN POLYMERIZATION CATALYST SYSTEM, PRODUCING AND USING IT BOREALIS A/S (DK) 1998-11-11 EP disclosed
US-5703149-A Process for the preparation of stabilized olefin polymers CIBA SPECIALTY CHEMICALS CORPORATION (US) 1997-12-30 US disclosed
EP-0567952-B1 Olefin polymerization catalyst, process for its preparation, and its use HOECHST AG (DE) 1997-12-03 EP disclosed
WO-1997027224-A1 OLEFIN POLYMERIZATION CATALYST SYSTEM, PRODUCING AND USING IT BOREALIS A/S (DK) 1997-07-31 WO disclosed
US-5614455-A Olefin polymerization catalyst, process for its preparation, and its use HOECHST AKTIENGESELLSCHAFT (DE) 1997-03-25 US disclosed
US-5578537-A Olefin polymerization catalyst process for its preparation and its use HOECHST AKTIENGESELLSCHAFT (DE) 1996-11-26 US disclosed
EP-0578838-A1 Olefin polymerization catalyst, process for its preparation, and its use HOECHST AKTIENGESELLSCHAFT (DE) 1994-01-19 EP disclosed
EP-0567952-A1 Olefin polymerization catalyst, process for its preparation, and its use HOECHST AKTIENGESELLSCHAFT (DE) 1993-11-03 EP disclosed