Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1487698

CCOC(=O)[C@@H](N)CCC(N)=O.Cl

nearest known ligand 0.52

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
DPP4 known ✓ P27487 1/20 0.42
GABRP known ✓ O00591 2/20 0.34
GABRD known ✓ O14764 2/20 0.34
GABRA1 known ✓ P14867 2/20 0.34
GABRB1 known ✓ P18505 2/20 0.34
GABRG2 known ✓ P18507 2/20 0.34
GABRB3 known ✓ P28472 2/20 0.34
GABRA5 known ✓ P31644 2/20 0.34
GABRA3 known ✓ P34903 2/20 0.34
GABRA2 known ✓ P47869 2/20 0.34
GABRB2 known ✓ P47870 2/20 0.34
GABRA4 known ✓ P48169 2/20 0.34
GABRE known ✓ P78334 2/20 0.34
GABRA6 known ✓ Q16445 2/20 0.34
GABRG1 known ✓ Q8N1C3 2/20 0.34
GABRG3 known ✓ Q99928 2/20 0.34
GABRQ known ✓ Q9UN88 2/20 0.34
GRIN2D known ✓ O15399 1/20 0.34
GRIN3B known ✓ O60391 1/20 0.34
GRIN1 known ✓ Q05586 1/20 0.34

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 SCHEMBL1487697 1.00 ALOX15 (0.52) ALOX15KMT2ABLMPMP22DPP4
SCHEMBL1538915 0.98 ALOX15 (0.54) ALOX15KMT2ABLMPMP22DPP4
SCHEMBL1538912 0.98 ALOX15 (0.54) ALOX15KMT2ABLMPMP22DPP4
Hydrochloric Acid SCHEMBL1176232 0.85 ALOX15 (0.46) ALOX15NOD1CYP2D6CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL7001552 0.85 ALOX15 (0.46) ALOX15NOD1CYP2D6CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL2012219 0.84 L3MBTL1 (0.51) ALOX15KMT2ANOD1CYP2D6CYP2C9
Hydrochloric Acid SCHEMBL134419 0.84 L3MBTL1 (0.51) ALOX15KMT2ANOD1CYP2D6CYP2C9
Hydrochloric Acid SCHEMBL8758700 0.84 GABRP (0.54) ALOX15KMT2ABLMDPP4DPP8
Hydrochloric Acid SCHEMBL8758697 0.84 GABRP (0.54) ALOX15KMT2ABLMDPP4DPP8
Hydrochloric Acid SCHEMBL134418 0.84 L3MBTL1 (0.51) ALOX15KMT2ANOD1CYP2D6CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111808011-B High penetration composition and its application 泰飞尔生物医药(苏州)有限公司 2024-02-27 CN disclosed
CN-108017555-B Beta-hydroxybutyryl-amino acid compound and preparation method and application thereof 郑州海斯威生物技术有限公司 2021-03-26 CN disclosed
WO-2019104851-A4 BETA-HYDROXYBUTYRYL-AMINO ACID COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 刘成 2019-08-15 WO disclosed
US-20110064720-A1 Dietary Supplement Compositions and Methods of Making and Using the Same AMATO DANIEL MOSES 2011-03-17 US disclosed
US-20110064712-A1 Dietary Supplement Compositions and Methods of Making and Using the Same AMATO DANIEL MOSES 2011-03-17 US disclosed
US-7749547-B2 Nutritional composition and method for increasing creatine uptake and retention in skeletal muscle, increasing muscle mass and strength, increasing exercise capacity and for aiding recovery following exercise NEW CELL FORMULATIONS LTD. (CA) 2010-07-06 US disclosed
US-20090142410-A1 Nutritional composition and method for increasing creatine uptake and retention in skeletal muscle, increasing muscle mass and strength, increasing exercise capacity and for aiding recovery following exercise HEUER MARVIN A 2009-06-04 US disclosed
US-20070196508-A1 Nutritional composition and method for increasing creatine uptake and retention in skeletal muscle, increasing muscle mass and strength, increasing exercise capacity and for aiding recovery following exercise HSBC BANK CANADA (CA) 2007-08-23 US disclosed
US-20050148669-A1 Amino acid esters as nutrient supplements and methods of use AMATO DANIEL (US) 2005-07-07 US disclosed
EP-0078152-B1 SALTS OF SULFODEHYDROABIETIC ACID AND TREATMENT OF GASTRO-INTESTINAL DISEASES Tanabe Seiyaku Co., Ltd. (JP) 1986-05-07 EP disclosed
US-4529602-A Sulfodehydroabietic acid compound TANABE SEIYAKU CO., LTD. (JP) 1985-07-16 US disclosed
EP-0078152-A1 Salts of sulfodehydroabietic acid and treatment of gastro-intestinal diseases Tanabe Seiyaku Co., Ltd. (JP) 1983-05-04 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 (3 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-20110064720-A1 Dietary Supplement Compositions and Methods of Making and Using the Same SLC5A6, PNLIP, LIPC DPP4 2759/4885GABRP 2703/4885GABRD 2014/4885
US-20110064712-A1 Dietary Supplement Compositions and Methods of Making and Using the Same SLC5A6, PNLIP, LIPC DPP4 2759/4885GABRP 2703/4885GABRD 2014/4885
US-20050148669-A1 Amino acid esters as nutrient supplements and methods of use SLC1A5, BCAT1, BCAT2 DPP4 391/4885GABRP 395/4885GABRD 711/4885

“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.