Hydrochloric Acid

Hydrochloric Acid

SCHEMBL396039

CN(C)C[Ti](C)(C)(C)(C)C1=CC=CC1.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
SCHEMBL4536665 0.98
Hydrochloric Acid SCHEMBL8462623 0.81
Hydrochloric Acid SCHEMBL396435 0.81
SCHEMBL4065998 0.78
Hydrochloric Acid SCHEMBL398061 0.78 KDM4E (0.32)
Hydrochloric Acid SCHEMBL8605941 0.77
SCHEMBL8587715 0.77
SCHEMBL4067664 0.76 ALDH1A1 (0.33)
Trimethylammonium SCHEMBL27268448 0.72
Hydrochloric Acid SCHEMBL138586 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0805142-B1 Cyclopentadiene compound substituted with a hetero atom-containing group DSM NV (NL) 1999-03-24 EP claimed
EP-3034546-B1 A process for the preparation of a block copolymer comprising a first polyolefin block and a second polymer block SABIC GLOBAL TECHNOLOGIES BV (NL) 2019-10-16 EP disclosed
EP-3034544-B1 A process for the preparation of a graft copolymer comprising a polyolefin main chain and one or a multiple polymer side chains SABIC GLOBAL TECHNOLOGIES BV (NL) 2019-10-16 EP disclosed
EP-3034547-B1 A process for the preparation of a block copolymer comprising a first polyolefin block and a second polymer block SABIC GLOBAL TECHNOLOGIES BV (NL) 2019-10-09 EP disclosed
US-20180251585-A1 PROCESS FOR THE PREPARATION OF A POLYOLEFIN HAVING ONE OR MULTIPLE PENDING FUNCTIONALITIES SABIC GLOBAL TECHNOLOGIES B.V. (NL) 2018-09-06 US disclosed
EP-3034546-A9 A process for the preparation of a block copolymer comprising a first polyolefin block and a second polymer block as well as the products obtained therefrom SABIC Global Technologies B.V. (NL) 2016-08-10 EP disclosed
EP-3037437-A1 Process for the preparation of a polyolefin having one or multiple end-functionalized branches. SABIC Global Technologies B.V. (NL) 2016-06-29 EP disclosed
EP-3037438-A1 Process for the preparation of a branched polyolefin SABIC Global Technologies B.V. (NL) 2016-06-29 EP disclosed
EP-3034546-A1 A process for the preparation of a block copolymer comprising a first polyolefin block and a second polymer block as well as the products obtained therefrom SABIC Global Technologies B.V. (NL) 2016-06-22 EP disclosed
EP-3034547-A1 A process for the preparation of a block copolymer comprising a first polyolefin block and a second polymer block and the products obtained therefrom SABIC Global Technologies B.V. (NL) 2016-06-22 EP disclosed
US-20010025085-A1 Aromatic vinyl resin material and molded products thereof IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2001-09-27 US disclosed
US-20010020075-A1 Catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-09-06 US disclosed
CN-1303872-A Component of polyaddition catalyst, polyaddition catalyst and process for preparing addition polymer SUMITOMO CHEMICAL CO (JP) 2001-07-18 CN disclosed
EP-1113026-A2 Catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-07-04 EP disclosed
US-6207753-B1 RESIN MATERIALS FOR PRODUCING MOLDED PRODUCTS ENDOWED WITH EXCELLENT HEAT RESISTANCE, SOLVENT RESISTANCE, TOUGHNESS, TENSILE ELONGATION AND TRANSPARENCY IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2001-03-27 US disclosed
EP-0985673-A2 Modified aluminium oxy compound, polymerization catalyst and process for producing olefin polymer and alkenyl aromatic hydrocarbon polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-03-15 EP disclosed
US-5986029-A POLYMERIZATION CATALYSTS FOR OLEFINS USING TRANSITION METAL COMPLEXES AND COCATALYST DSM N.V. (NL) 1999-11-16 US disclosed
EP-0911349-A1 Aromatic vinyl resin material and molded products thereof Idemitsu Petrochemical Co., Ltd. (JP) 1999-04-28 EP disclosed
EP-0911346-A2 Ethylene copolymer and aromatic vinyl graft copolymer and method for producing the same Idemitsu Petrochemical Co., Ltd. (JP) 1999-04-28 EP disclosed
EP-0789718-B1 CATALYST COMPOSITION AND PROCESS FOR THE POLYMERIZATION OF AN OLEFIN DSM NV (NL) 1998-04-08 EP disclosed