Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3088650

C=CCC(=O)CCCCC.Cl

nearest known ligand 0.48

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.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG known ✓ P37231 6/20 0.43
HDAC11 known ✓ Q96DB2 5/20 0.43
ESR1 known ✓ P03372 1/20 0.43
PDE4A known ✓ P27815 1/20 0.43
PDE3A known ✓ Q14432 1/20 0.43
TSHR P16473 5/20 0.48
FAAH O00519 3/20 0.48
KMT2A Q03164 2/20 0.48
MAPT P10636 1/20 0.48
CES2 O00748 4/20 0.46
CES1 P23141 4/20 0.46
AKR1B1 P15121 1/20 0.44
HAO1 Q9UJM8 1/20 0.44
PPARD Q03181 6/20 0.43
PPARA Q07869 6/20 0.43
GPR84 Q9NQS5 5/20 0.43
ALDH1A1 P00352 2/20 0.43
TLR2 O60603 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
FABP4 P15090 2/20 0.43

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 SCHEMBL3634285 0.98 KMT2A (0.52) TSHRFAAHKMT2AMAPTCES2
SCHEMBL176299 0.98 TSHR (0.50) TSHRFAAHKMT2AMAPTCES2
SCHEMBL3131865 0.96 KMT2A (0.54) TSHRFAAHKMT2AMAPTCES2
SCHEMBL11795366 0.96 KMT2A (0.54) TSHRFAAHKMT2AMAPTCES2
Hydrogen Sulfide SCHEMBL9539728 0.96 TSHR (0.48) TSHRFAAHKMT2AMAPTCES2
SCHEMBL11796286 0.96 KMT2A (0.54) TSHRFAAHKMT2AMAPTCES2
SCHEMBL9295757 0.96 KMT2A (0.54) TSHRFAAHKMT2AMAPTCES2
SCHEMBL9539734 0.96 TSHR (0.48) TSHRFAAHKMT2AMAPTCES2
SCHEMBL3632919 0.96 KMT2A (0.54) TSHRFAAHKMT2AMAPTCES2
SCHEMBL29284351 0.94 KMT2A (0.52) TSHRFAAHKMT2AMAPTCES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117986239-A Irbesartan preparation method 珠海润都制药股份有限公司 2024-05-07 CN claimed
EP-1853591-A1 METHOD FOR OBTAINING A PHARMACEUTICALLY ACTIVE COMPOUND (IRBESARTAN) AND ITS SYNTHESIS INTERMEDIATE INKE, S.A. (ES) 2007-11-14 EP claimed
WO-2006089927-A1 METHOD FOR OBTAINING A PHARMACEUTICALLY ACTIVE COMPOUND (IRBESARTAN) AND ITS SYNTHESIS INTERMEDIATE INKE, S.A. (ES) 2006-08-31 WO claimed
CN-117986239-A Irbesartan preparation method 珠海润都制药股份有限公司 2024-05-07 CN disclosed
CN-117836294-A Biological antagonist containing aromatic ring, preparation method and application thereof 上海翰森生物医药科技有限公司 2024-04-05 CN disclosed
CN-117085013-A Biphenyl sulfonamide compounds useful for treating kidney diseases or conditions 特拉维尔治疗公司 2023-11-21 CN disclosed
CN-117017985-A Biphenyl sulfonamide compounds useful for treating kidney diseases or conditions 特拉维尔治疗公司 2023-11-10 CN disclosed
CN-116983302-A Biphenyl sulfonamide compounds useful for treating kidney diseases or conditions 特拉维尔治疗公司 2023-11-03 CN disclosed
CN-114788823-A Biphenyl sulfonamide compounds for use in the treatment of renal diseases or disorders 特拉维尔治疗公司 2022-07-26 CN disclosed
CN-105001209-A Synthetic method of irbesartan CHEER FINE PHARMACEUTICAL ANHUI CO LTD 2015-10-28 CN disclosed
US-7799928-B2 Process for the preparation of irbesartan hydrochloride CIPLA LIMITED (IN) 2010-09-21 US disclosed
EP-0998463-B1 PROCESS FOR THE PREPARATION OF 1,3-DIAZA-SPIRO (4.4) NON-1-EN-4-ONE DERIVATIVES AND 1-CYANO-1-ACYLAMINOCYCLOPENTANE INTERMEDIATES SANOFI SYNTHELABO (FR) 2003-04-02 EP disclosed
EP-0998462-B1 PROCESS FOR THE PREPARATION OF 1,3-DIAZA-SPIRO (4.4) NON-1-EN-4-ONE DERIVATIVES AND 1-CYANO-1-ACYLAMINO-CYCLOPENTANE INTERMEDIATES SANOFI SYNTHELABO (FR) 2002-10-30 EP disclosed
US-6239286-B1 REACTING 1-AMINO-1-CYANOCYCLOPENTANE WITH AN ACYL HALIDE; THEN AN ANHYDRIDE SANOFI-SYNTHELABO (FR) 2001-05-29 US disclosed
EP-0998463-A1 PROCESS FOR THE PREPARATION OF 1,3-DIAZA-SPIRO (4.4) NON-1-EN-4-ONE DERIVATIVES AND 1-CYANO-1-ACYLAMINOCYCLOPENTANE INTERMEDIATES SANOFI-SYNTHELABO (FR) 2000-05-10 EP disclosed
EP-0998462-A1 PROCESS FOR THE PREPARATION OF 1,3-DIAZA-SPIRO (4.4) NON-1-EN-4-ONE DERIVATIVES AND 1-CYANO-1-ACYLAMINO-CYCLOPENTANE INTERMEDIATES SANOFI-SYNTHELABO (FR) 2000-05-10 EP disclosed
EP-0998461-A1 PROCESS FOR THE PREPARATION OF IMIDAZOLONES SANOFI-SYNTHELABO (FR) 2000-05-10 EP disclosed
WO-1999005120-A1 PROCESS FOR THE PREPARATION OF 1,3-DIAZA-SPIRO (4.4) NON-1-EN-4-ONE DERIVATIVES AND 1-CYANO-1-ACYLAMINOCYCLOPENTANE INTERMEDIATES SANOFI-SYNTHELABO (FR) 1999-02-04 WO disclosed
WO-1999005119-A1 PROCESS FOR THE PREPARATION OF 1,3-DIAZA-SPIRO (4.4) NON-1-EN-4-ONE DERIVATIVES AND 1-CYANO-1-ACYLAMINO-CYCLOPENTANE INTERMEDIATES SANOFI-SYNTHELABO (FR) 1999-02-04 WO disclosed
WO-1999005118-A1 PROCESS FOR THE PREPARATION OF IMIDAZOLONES SANOFI-SYNTHELABO (FR) 1999-02-04 WO disclosed