Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4445313

CCCCCCCCCCCC(CC)(CC)C(N)c1ccccc1.Cl

nearest known ligand 0.42

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 13)

geneUniProtsupporting neighboursconfidence
HTR2A known ✓ P28223 1/20 0.42
KCNH2 known ✓ Q12809 1/20 0.35
CYP19A1 known ✓ P11511 3/20 0.35
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
CSNK1E P49674 1/20 0.38
NAAA Q02083 2/20 0.37
ATM Q13315 1/20 0.36
MAPK1 P28482 1/20 0.36
ASAH1 Q13510 2/20 0.35
SLC2A1 P11166 1/20 0.35
ALDH1A1 P00352 1/20 0.35
ACER2 Q5QJU3 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
Hydrochloric Acid SCHEMBL8900598 0.93 HTR2A (0.44) HTR2AMEN1KMT2ACSNK1ENAAA
Hydrochloric Acid SCHEMBL8527492 0.86 ALDH1A1 (0.37) HTR2AALDH1A1
Water SCHEMBL8528862 0.83 DPP4 (0.37) HTR2A
Hydrochloric Acid SCHEMBL8530463 0.82 DPP4 (0.42) HTR2AALDH1A1
Hydrochloric Acid SCHEMBL6122957 0.82 HTR2A (0.43) HTR2AMEN1KMT2ACSNK1ENAAA
Hydrochloric Acid SCHEMBL4799254 0.82 HTR2A (0.43) HTR2AMEN1KMT2ACSNK1ENAAA
Hydrochloric Acid SCHEMBL1170862 0.82 HTR2A (0.43) HTR2AMEN1KMT2ACSNK1ENAAA
Hydrochloric Acid SCHEMBL4618491 0.82 HTR2A (0.43) HTR2AMEN1KMT2ACSNK1ENAAA
Hydrochloric Acid SCHEMBL4800361 0.82 HTR2A (0.43) HTR2AMEN1KMT2ACSNK1ENAAA
Hydrochloric Acid SCHEMBL11785349 0.82 HTR2A (0.43) HTR2AMEN1KMT2ACSNK1ENAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4764527-A Hydroxypyrazole derivatives, composition containing them and their use against microorganisms BASF AKTIENGESELLSCHAFT (DE) 1988-08-16 US claimed
US-7582694-B2 Antimicrobial lubricant for wood fiber-plastic composites LONZA, INC. (US) 2009-09-01 US disclosed
EP-1567586-B1 ANTIMICROBIAL LUBRICANT FOR WOOD FIBER-PLASTIC COMPOSITES LONZA AG (US) 2008-01-09 EP disclosed
EP-1567586-A4 ANTIMICROBIAL LUBRICANT FOR WOOD FIBER-PLASTIC COMPOSITES LONZA AG (US) 2006-08-16 EP disclosed
US-20050256231-A1 Antimicrobial lubricant for wood fiber-plastic composites LONZA INC. (US) 2005-11-17 US disclosed
EP-1567586-A2 ANTIMICROBIAL LUBRICANT FOR WOOD FIBER-PLASTIC COMPOSITES LONZA INC. (US) 2005-08-31 EP disclosed
WO-2004022846-A2 ANTIMICROBIAL LUBRICANT FOR WOOD FIBER-PLASTIC COMPOSITES LONZA INC. (US) 2004-03-18 WO disclosed
US-6268514-B1 TREATING INDUSTRIAL MATERIALS WITH NITROETHANE COMPOUND FOR PROTECTING AGAINST ATTACK AND DESTRUCTION BY MICROORGANISMS BASF AKTIENGESELLSCHAFT (DE) 2001-07-31 US disclosed
EP-0485079-B2 Aqueous composition AVECIA LTD (GB) 2001-02-28 EP disclosed
US-6069161-A TREATING THE INDUSTRIAL MATERIAL WITH AMINOISOTHIAZOLE MICROBIOCIDE BASF AKTIENGESELLSCHAFT (DE) 2000-05-30 US disclosed
US-5112871-A ANTI-MICROBIAL BROMO-NITRO COMPOUNDS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-05-12 US disclosed
EP-0478194-A1 Bis-(2-Aminocarbonylcycloalk-1-enyl)-disulfides, their preparation and use ZENECA LIMITED (GB) 1992-04-01 EP disclosed
EP-0478173-A1 Derivatives of 4,5-polymethylene-4-isothiazoline-3 ones and their use as biocides ZENECA LIMITED (GB) 1992-04-01 EP disclosed
WO-1992001380-A1 BIOCIDE COMPOSITION IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-02-06 WO disclosed
EP-0457435-A2 Biocide composition and use ZENECA LIMITED (GB) 1991-11-21 EP disclosed
EP-0409617-A2 Thiolactams, process for their preparation and use as biocides ZENECA LIMITED (GB) 1991-01-23 EP disclosed
EP-0390394-A2 Composition and use ZENECA LIMITED (GB) 1990-10-03 EP disclosed
EP-0373759-A1 Compound, composition, process and use IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1990-06-20 EP disclosed
US-4764527-A Hydroxypyrazole derivatives, composition containing them and their use against microorganisms BASF AKTIENGESELLSCHAFT (DE) 1988-08-16 US disclosed
US-4173643-A 4-ISOTHIAZOLINE-3-ONES ROHM AND HAAS COMPANY (US) 1979-11-06 US disclosed