Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1195199

CCCCCCCCC=CCCCCCCCC(=O)NCCCN(C)C.CCCCCCCCCCCCCCCCCC(=O)NCCCN(C)C.Cl.Cl

nearest known ligand 0.80

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 15)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.80
SLC6A5 Q9Y345 2/20 0.68
EPHX2 P34913 2/20 0.68
CNR1 P21554 4/20 0.66
ALDH1A1 P00352 2/20 0.66
HPGD P15428 2/20 0.66
TRPV1 Q8NER1 1/20 0.66
MEN1 O00255 1/20 0.66
MAPT P10636 1/20 0.66
ALOX12 P18054 1/20 0.66
BLM P54132 1/20 0.66
KMT2A Q03164 1/20 0.66
TDP1 Q9NUW8 1/20 0.66
KDM4E B2RXH2 1/20 0.63
LPAR1 Q92633 1/20 0.63

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 SCHEMBL30468934 1.00 DNM1 (0.80) DNM1SLC6A5EPHX2CNR1ALDH1A1
SCHEMBL6127761 0.99 DNM1 (0.82) DNM1SLC6A5EPHX2CNR1ALDH1A1
SCHEMBL6417641 0.99 DNM1 (0.82) DNM1SLC6A5EPHX2CNR1ALDH1A1
SCHEMBL4622859 0.99 DNM1 (0.82) DNM1SLC6A5EPHX2CNR1ALDH1A1
SCHEMBL75309 0.99 DNM1 (0.82) DNM1SLC6A5EPHX2CNR1ALDH1A1
SCHEMBL25134837 0.99 DNM1 (0.82) DNM1SLC6A5EPHX2CNR1ALDH1A1
SCHEMBL9505196 0.99 DNM1 (0.82) DNM1SLC6A5EPHX2CNR1ALDH1A1
SCHEMBL14060400 0.99 DNM1 (0.82) DNM1SLC6A5EPHX2CNR1ALDH1A1
SCHEMBL3427754 0.99 DNM1 (0.82) DNM1SLC6A5EPHX2CNR1ALDH1A1
Hydrochloric Acid SCHEMBL28527824 0.96 DNM1 (0.74) DNM1CNR1ALDH1A1HPGDTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2325278-B1 Polycationic viscoelastic compositions STEPAN CO (US) 2015-09-09 EP disclosed
US-8222455-B2 Polycationic viscoelastic compositions STEPAN COMPANY (US) 2012-07-17 US disclosed
EP-1945734-B1 POLYCATIONIC VISCOELASTIC COMPOSITIONS STEPAN CO (US) 2011-08-17 EP disclosed
US-20110190530-A1 Polycationic Viscoelastic Compositions KNOX PAUL 2011-08-04 US disclosed
EP-2325278-A1 Polycationic viscoelastic compositions STEPAN COMPANY (US) 2011-05-25 EP disclosed
US-7947633-B2 Polycationic viscoelastic compositions STEPAN COMPANY (US) 2011-05-24 US disclosed
US-7884057-B2 Quaternary ammonium compounds with two cationic sites connected through a linker; hydraulic fluids, demulsifiers, foamers, organoclays, thickeners, biocides, and oil field fluids. STEPAN COMPANY (US) 2011-02-08 US disclosed
US-7879769-B2 Quaternary ammonium compounds with two cationic sites connected through a linker; hydraulic fluids, demulsifiers, foamers, organoclays, thickeners, biocides, and oil field fluids. STEPAN COMPANY (US) 2011-02-01 US disclosed
US-20100311622-A1 Polycationic Viscoelastic Compositions KNOX PAUL 2010-12-09 US disclosed
US-7772165-B2 Polycationic viscoelastic compositions STEPHAN COMPANY (US) 2010-08-10 US disclosed
EP-1945734-A4 POLYCATIONIC VISCOELASTIC COMPOSITIONS STEPAN CO (US) 2008-12-03 EP disclosed
US-20080255009-A1 Quaternary ammonium compounds with two cationic sites connected through a linker; hydraulic fluids, demulsifiers, foamers, organoclays, thickeners, biocides, and oil field fluids. STEPAN COMPANY 2008-10-16 US disclosed
US-20080248976-A1 POLYCATIONIC VISCOELASTIC COMPOSITIONS STEPAN COMPANY 2008-10-09 US disclosed
US-20080248977-A1 Quaternary ammonium compounds with two cationic sites connected through a linker; hydraulic fluids, demulsifiers, foamers, organoclays, thickeners, biocides, and oil field fluids. STEPAN COMPANY 2008-10-09 US disclosed
EP-1945734-A2 POLYCATIONIC VISCOELASTIC COMPOSITIONS STEPAN COMPANY (US) 2008-07-23 EP disclosed
WO-2007056392-A9 POLYCATIONIC VISCOELASTIC COMPOSITIONS STEPAN CO (US) 2007-07-05 WO disclosed
WO-2007056393-A2 POLYCATIONIC VISCOELASTIC COMPOSITIONS STEPAN COMPANY (US) 2007-05-18 WO disclosed
WO-2007056284-A2 POLYCATIONIC VISCOELASTIC COMPOSITIONS STEPAN COMPANY (US) 2007-05-18 WO disclosed
WO-2007056392-A2 POLYCATIONIC VISCOELASTIC COMPOSITIONS STEPAN COMPANY (US) 2007-05-18 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 (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-20110190530-A1 Polycationic Viscoelastic Compositions AQP1, PBRM1, PARG DNM1 137/4885SLC6A5 696/4885EPHX2 4431/4885

“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.