Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1242368

CCOC(=O)CN(C)C(=N)N.Cl

nearest known ligand 0.56

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
CA2 known ✓ P00918 6/20 0.56
GAA known ✓ P10253 1/20 0.41
CA1 P00915 6/20 0.56
CA12 O43570 1/20 0.56
CA9 Q16790 1/20 0.56
ALOX15 P16050 1/20 0.41
MGAM O43451 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
ALDH1A1 P00352 5/20 0.39
TRPA1 O75762 1/20 0.39
CYP1A2 P05177 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
NOS2 P35228 1/20 0.35
F2 P00734 3/20 0.35
F10 P00742 1/20 0.35
LMNA P02545 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL672097 0.98 CA1 (0.58) CA1CA2CA12CA9ALOX15
Bicarbonate SCHEMBL4899567 0.94 CA1 (0.55) CA1CA2CA12CA9ALOX15
Butanedione SCHEMBL17913120 0.93 CA1 (0.53) CA1CA2CA12CA9ALOX15
Sulfuric Acid SCHEMBL2396292 0.91 CA1 (0.51) CA1CA2CA12CA9ALOX15
Pyruvate SCHEMBL4586594 0.90 CA1 (0.50) CA1CA2CA12CA9ALOX15
SCHEMBL19152428 0.86 CA1 (0.42) CA1CA2CA12CA9ALOX15
SCHEMBL4098848 0.83 CA1 (0.42) CA1CA2CA12CA9ALDH1A1
SCHEMBL4586999 0.82 CA12 (0.62) CA1CA2CA12CA9ALOX15
Malic Acid SCHEMBL31238937 0.82 CA12 (0.43) CA1CA2CA12CA9ALOX15
SCHEMBL4589521 0.80 NAAA (0.43) CA1CA2CA12CA9ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250017886-A1 FORMULATIONS AND METHODS FOR INCREASING CREATININE LEVELS IN PLASMA, EXTRACELLULAR FLUID AND/OR INTRACELLULAR COMPARTMENTS VIREO SYSTEMS, INC. (US) 2025-01-16 US claimed
US-20250017904-A1 ANTIMICROBIAL COMPOSITIONS CONTAINING A SYNERGISTIC COMBINATION OF ACTIVATED CREATININE AND AN IMIDAZOLE ANTIFUNGAL AGENT BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 2025-01-16 US claimed
CN-116606225-A Preparation method of creatine ethyl ester hydrochloride 天津天鼎仁科技有限公司 2023-08-18 CN claimed
CN-116143663-A Preparation method of creatine ethyl ester hydrochloride 安徽泰格生物科技有限公司 2023-05-23 CN claimed
CN-108929249-B Synthetic process of ethyl creatine hydrochloride 山东第一医科大学(山东省医学科学院) 2021-10-08 CN claimed
US-20160296449-A1 Semi-Permanent Hair Straightening Composition And Method LUBRIZOL ADVANCED MATERIALS, INC. 2016-10-13 US claimed
EP-3065831-A1 SEMI-PERMANENT HAIR STRAIGHTENING COMPOSITION AND METHOD Lubrizol Advanced Materials, Inc. (US) 2016-09-14 EP claimed
CN-105916556-A Semi-permanent hair straightening composition and method 路博润先进材料公司 2016-08-31 CN claimed
WO-2015069823-A1 SEMI-PERMANENT HAIR STRAIGHTENING COMPOSITION AND METHOD LUBRIZOL ADVANCED MATERIALS, INC. (US) 2015-05-14 WO claimed
US-20110172306-A1 CREATINE ESTER PRONUTRIENT COMPOUNDS AND FORMULATIONS VENNERSTROM JONATHAN L 2011-07-14 US claimed
US-7786073-B2 Container for dietary supplement having improved efficacy at time of consumption HSBC BANK CANADA (CA) 2010-08-31 US claimed
US-20070280996-A1 Dietary supplement having improved efficacy at time of consumption HSBC BANK CANADA (CA) 2007-12-06 US claimed
US-20070203076-A1 CREATINE ESTER PRONUTRIENT COMPOUNDS AND FORMULATIONS VENNERSTROM JONATHAN L 2007-08-30 US claimed
US-20060251727-A1 Supplemental dietary composition for increasing muscle size, strength, athletic performance and/or exercise capacity NEW CELL FORMULATIONS LTD. (CA) 2006-11-09 US claimed
US-12564567-B2 Antiviral therapeutic compounds and compositions for use in treatment of coronavirus and influenza virus VIREO SYSTEMS, INC. (US) 2026-03-03 US disclosed
US-20250082597-A1 METHOD FOR TREATING TAUOPATHY IN THE BRAIN, BRAIN STEM AND SPINAL COLUMN TEDONE 3G LLC (US) 2025-03-13 US disclosed
CN-119462434-A Preparation method of creatine ethyl ester hydrochloride 连云港盛和生物科技有限公司 2025-02-18 CN disclosed
US-20030212130-A1 Creatine ester anti-inflammatory compounds and formulations NEBRASKA, UNIVERSITY OF MEDICAL CENTER 2003-11-13 US disclosed
EP-1324760-A1 CREATINE ESTER PRONUTRIENT COMPOUNDS AND FORMULATIONS Board of Regents of the University of Nebraska (US) 2003-07-09 EP disclosed
WO-2002022135-A1 CREATINE ESTER PRONUTRIENT COMPOUNDS AND FORMULATIONS BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 2002-03-21 WO 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 (9 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-20030212130-A1 Creatine ester anti-inflammatory compounds and formulations CKMT1A; CKMT1B, CPT1B, CRAT CA2 901/4885GAA 1972/4885CA1 2415/4885
US-20250017886-A1 FORMULATIONS AND METHODS FOR INCREASING CREATININE LEVELS IN PLASMA, EXTRACELLULAR FLUID AND/OR INTRACELLULAR COMPARTMENTS GLS, ALB, REN CA2 2553/4885GAA 1208/4885CA1 2637/4885
US-20060251727-A1 Supplemental dietary composition for increasing muscle size, strength, athletic performance and/or exercise capacity CKMT1A; CKMT1B, CPT1B, GYS1 CA2 1140/4885GAA 700/4885CA1 2304/4885
US-20250017904-A1 ANTIMICROBIAL COMPOSITIONS CONTAINING A SYNERGISTIC COMBINATION OF ACTIVATED CREATININE AND AN IMIDAZOLE ANTIFUNGAL AGENT CAT, PRKDC, REN CA2 521/4885GAA 565/4885CA1 1640/4885
US-12564567-B2 Antiviral therapeutic compounds and compositions for use in treatment of coronavirus and influenza virus CKMT1A; CKMT1B, CPT1B, MAVS CA2 1074/4885GAA 2004/4885CA1 2568/4885
US-20110172306-A1 CREATINE ESTER PRONUTRIENT COMPOUNDS AND FORMULATIONS CKMT1A; CKMT1B, CPT1B, PYGM CA2 3569/4885GAA 1272/4885CA1 3741/4885
US-20250082597-A1 METHOD FOR TREATING TAUOPATHY IN THE BRAIN, BRAIN STEM AND SPINAL COLUMN BCKDK, ATXN10, SLC1A2 CA2 1009/4885GAA 4/4885CA1 719/4885
US-20160296449-A1 Semi-Permanent Hair Straightening Composition And Method KRT18, PRKDC, DNMT1 CA2 3006/4885GAA 2921/4885CA1 1157/4885
US-20070203076-A1 CREATINE ESTER PRONUTRIENT COMPOUNDS AND FORMULATIONS CKMT1A; CKMT1B, CPT1B, PYGM CA2 3569/4885GAA 1272/4885CA1 3741/4885

“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.