Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4132474

COC(C)OC.Cl.[Ni]

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
SCHEMBL3473432 0.95
Hydrochloric Acid SCHEMBL3802580 0.95
Hydrochloric Acid SCHEMBL6498284 0.91
Bromide SCHEMBL5320181 0.91
SCHEMBL11615697 0.91
SCHEMBL1153 0.91
SCHEMBL5306546 0.91 LMNA (0.31)
Water SCHEMBL5322619 0.86
Water SCHEMBL1269330 0.86
Bromide SCHEMBL7648010 0.86

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
CN-118084841-A Synthesis method of high-purity delta-lactone 江西香海生物科技有限公司 2024-05-28 CN claimed
CN-116354995-A Boron-containing chiral allyl ester compound and high-stereoselectivity synthesis method 武汉大学 2023-06-30 CN claimed
CN-111454150-B Synthesis method of (S) -2-aryl propionate compound 南京工业大学 2023-03-28 CN claimed
CN-111423299-B Photochemical catalytic synthesis method of aryl olefin compound 北京工商大学 2023-03-10 CN claimed
CN-115772133-A Preparation method of bis-ethylhexyloxyphenol methoxyphenyl triazine 安徽英特美科技有限公司 2023-03-10 CN claimed
CN-115536572-A Sulfonyl hydrazide compound and preparation method and application thereof 中国科学技术大学 2022-12-30 CN claimed
CN-111423331-B Photochemical catalytic synthesis method of aryl alkyl ether 北京工商大学 2022-11-11 CN claimed
CN-111039822-B Photochemical catalytic synthesis method of aromatic azo compound 北京工商大学 2022-11-11 CN claimed
CN-114805170-A Preparation method of novel silodosin chiral intermediate 四川青木制药有限公司 2022-07-29 CN claimed
CN-110256205-B Method for removing olefin protective group by nickel catalysis 常熟理工学院 2022-02-11 CN claimed
CN-113666862-A Method for preparing chiral 3-nitroindole compound by nickel-catalyzed asymmetric nitration reaction 山东大学 2021-11-19 CN claimed
CN-109096149-B Process for the preparation of beta-arylamines 富兰克科技(深圳)股份有限公司 2021-02-26 CN claimed
CN-111454150-A Synthesis method of (S) -2-aryl propionate compound 南京工业大学 2020-07-28 CN claimed
US-5221774-A Catalyst system containing nickel chloride, phosphine compound zinc and fluorinated organoacid PHILLIPS PETROLEUM COMPANY (US) 1993-06-22 US claimed
US-12037324-B2 Biarylmethyl heterocycles BRISTOL-MYERS SQUIBB COMPANY (US) 2024-07-16 US disclosed
CN-118201921-A Lactams as CBL-B inhibitors selective for C-CBL 基因泰克公司 2024-06-14 CN disclosed
WO-2024114704-A1 NOVEL IRAK4 INHIBITOR, AND COMPOUND FOR INHIBITING AND DEGRADING IRAK4 PROTEIN AND PREPARATION METHOD THEREFOR AND USE THEREOF 深圳众格生物科技有限公司 2024-06-06 WO disclosed
EP-1284258-A2 Mono-, oligo- and polyalkylidenefluorenes and their use as charge transport materials MERCK PATENT GmbH (DE) 2003-02-19 EP disclosed
US-5233115-A Using nickel halide, phosphine, carboxylate compound followed by contact with alkali metal borohydride PHILLIPS PETROLEUM COMPANY (US) 1993-08-03 US disclosed
US-5221774-A Catalyst system containing nickel chloride, phosphine compound zinc and fluorinated organoacid PHILLIPS PETROLEUM COMPANY (US) 1993-06-22 US disclosed