Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5538296

C=C(C)C(=O)OCCC(NC)(NC)NC.Cl

nearest known ligand 0.47

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 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.47
TSHR P16473 3/20 0.46
ALDH1A1 P00352 2/20 0.40
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL10495130 0.98 THRB (0.48) THRBTSHRALDH1A1POLBAPEX1
Hydrochloric Acid SCHEMBL248062 0.81 TSHR (0.44) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL10349505 0.80 THRB (0.53) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL1898732 0.79 THRB (0.44) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL676411 0.79 TSHR (0.45) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL26002227 0.78 THRB (0.55) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL25431379 0.77 THRB (0.50) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL438464 0.76 THRB (0.53) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL8965485 0.76 THRB (0.53) THRBTSHRALDH1A1POLBAPEX1
Methacrylic Acid SCHEMBL28409147 0.76 THRB (0.48) THRBTSHRALDH1A1POLBAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1337594-B1 TITANIUM DIOXIDE AQUEOUS DISPERSION, SUBSTRATE OBTAINED FROM SAID DISPERSION AND SELF-CLEANING METHOD FOR SAID SUBSTRATE RHODIA CHIMIE SA (FR) 2007-07-04 EP claimed
US-6905814-B1 Use of film-forming titanium dioxide dispersions for cleaning and disinfecting surfaces, film-forming titanium dioxide dispersions RHODIA CHIMIE 2005-06-14 US claimed
US-20020090349-A1 Process for the biocidal treatment of surface BERGERON VANCE (FR) 2002-07-11 US claimed
EP-1094706-A1 PROCESS FOR THE BIOCIDAL TREATMENT OF SURFACES RHODIA CHIMIE (FR) 2001-05-02 EP claimed
WO-2000002449-A1 PROCESS FOR THE BIOCIDAL TREATMENT OF SURFACES RHODIA CHIMIE (FR) 2000-01-20 WO claimed
US-4791161-A CONTAINING UNSATURATED TERTIARY NITROGEN COMPOUNDS RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1988-12-13 US claimed
US-4525519-A POLYMERIZATION IN AQUEOUS DISPERSION OF UNSATURATED NITROGEN COMPOUND AND CATIONIC EMULSION RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1985-06-25 US claimed
US-20070128142-A1 Emulsion for conveying a hydrophobic active material to a substrate in aqueous medium RHODIA CHIMIE (FR) 2007-06-07 US disclosed
US-20060194711-A1 Preformulated additive for a composition for treating textile fiber articles and use of said additive as care agent PROCTER & GAMBLE COMPAMY, THE 2006-08-31 US disclosed
US-6905814-B1 Use of film-forming titanium dioxide dispersions for cleaning and disinfecting surfaces, film-forming titanium dioxide dispersions RHODIA CHIMIE 2005-06-14 US disclosed
US-20030050218-A1 Preformulated additive for a composition for treating textile fiber articles and use of said additive as care agent PROCTER & GAMBLE COMPAMY, THE 2003-03-13 US disclosed
US-20020090349-A1 Process for the biocidal treatment of surface BERGERON VANCE (FR) 2002-07-11 US disclosed
EP-1094706-A1 PROCESS FOR THE BIOCIDAL TREATMENT OF SURFACES RHODIA CHIMIE (FR) 2001-05-02 EP disclosed
WO-2000002449-A1 PROCESS FOR THE BIOCIDAL TREATMENT OF SURFACES RHODIA CHIMIE (FR) 2000-01-20 WO disclosed
US-4525519-A POLYMERIZATION IN AQUEOUS DISPERSION OF UNSATURATED NITROGEN COMPOUND AND CATIONIC EMULSION RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1985-06-25 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070128142-A1 Emulsion for conveying a hydrophobic active material to a substrate in aqueous medium PHOSPHO1, PMM2, SAMM50 THRB 4588/4885TSHR 4681/4885ALDH1A1 4337/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.