Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7635242

CCCCNC(=O)O.CCCCNC(=O)O.Cl.Cl.NCCN(CCO)CCO

nearest known ligand 0.39

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 10)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 8/20 0.39
RRM1 known ✓ P23921 1/20 0.36
EPHX1 P07099 4/20 0.37
ALOX15 P16050 1/20 0.37
NAAA Q02083 1/20 0.37
DPP7 Q9UHL4 1/20 0.36
DNM1 Q05193 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MMP2 P08253 1/20 0.35
SLC6A5 Q9Y345 1/20 0.35

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
SCHEMBL7900843 0.98 ACHE (0.40) ACHEEPHX1ALOX15NAAADPP7
SCHEMBL7617282 0.79 KDM5A (0.47) ACHEEPHX1NAAADNM1ALDH1A1
SCHEMBL18074396 0.79 KDM5A (0.47) ACHEEPHX1NAAADNM1ALDH1A1
SCHEMBL7600192 0.79 ALDH1A1 (0.42) ALOX15NAAADNM1ALDH1A1
Butylamine SCHEMBL909929 0.77 EPHX1 (0.48) ACHEEPHX1ALOX15DPP7RRM1
Hydrochloric Acid SCHEMBL2398903 0.77
Butane SCHEMBL28879542 0.77 EPHX1 (0.56) ACHEEPHX1ALOX15MMP2
SCHEMBL11146017 0.76 DRD2 (0.49) EPHX1ALOX15DNM1ALDH1A1
SCHEMBL20548058 0.76 NAAA (0.47) ACHEEPHX1NAAADNM1ALDH1A1
SCHEMBL15542027 0.75 CA12 (0.37) ACHEALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020142041-A1 Antiulcer agents TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2002-10-03 US disclosed
US-6368635-B1 SOLID MATRIX; SUSTAINED RELEASE; DRUG DELIVERY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-04-09 US disclosed
US-5731006-A POLYGLYCEROL FATTY ACID ESTER AS SOLID MATRIX TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-03-24 US disclosed
EP-0514008-B1 Pharmaceutical preparations based on gastrointestinal mucosa-adherent matrixes or coatings TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1997-03-05 EP disclosed
US-5576025-A POLYGLYCEROL FATTY ESTER TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-11-19 US disclosed
US-5443846-A Containing polyglycerol fatty acid ester; stability TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1995-08-22 US disclosed
EP-0455391-B1 Granulated preparations and method of producing the same TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1994-10-12 EP disclosed
EP-0514008-A1 Pharmaceutical preparations based on gastrointestinal mucosa-adherent matrixes or coatings TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-11-19 EP disclosed
EP-0455391-A2 Granulated preparations and method of producing the same Takeda Chemical Industries, Ltd. (JP) 1991-11-06 EP 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-20020142041-A1 Antiulcer agents FASN, GAA, NSF ACHE 1627/4885RRM1 1088/4885EPHX1 1800/4885

“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.