Hydrochloric Acid

Hydrochloric Acid

SCHEMBL11344471

C=CC(CCCCCCCCCCCCCCCCCCN(C)C)c1ccccc1.Cl

nearest known ligand 0.53

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
HTR2A known ✓ P28223 4/20 0.53
HRH1 known ✓ P35367 4/20 0.53
SIGMAR1 known ✓ Q99720 3/20 0.45
CHRM2 known ✓ P08172 2/20 0.39
SLC6A2 known ✓ P23975 2/20 0.39
SLC6A4 known ✓ P31645 2/20 0.39
SCN1A known ✓ P35498 2/20 0.39
SCN2A known ✓ Q99250 2/20 0.39
SCN3A known ✓ Q9NY46 2/20 0.39
CHRM4 known ✓ P08173 1/20 0.39
CHRM5 known ✓ P08912 1/20 0.39
ADRA2A known ✓ P08913 1/20 0.39
CHRM1 known ✓ P11229 1/20 0.39
ADRA2B known ✓ P18089 1/20 0.39
CHRM3 known ✓ P20309 1/20 0.39
HRH2 known ✓ P25021 1/20 0.39
HTR2C known ✓ P28335 1/20 0.39
ADRA1A known ✓ P35348 1/20 0.39
OPRM1 known ✓ P35372 1/20 0.39
DRD3 known ✓ P35462 1/20 0.39

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
SCHEMBL25968037 0.85 HTR2A (0.60) HTR2AHRH1LMNAKDM4EMAPK1
SCHEMBL10985023 0.81 SIGMAR1 (0.46) HTR2AHRH1SIGMAR1LMNASMN1; SMN2
SCHEMBL17183731 0.80 HTR2A (0.41) HTR2ASIGMAR1TDP1OPRM1OPRK1
SCHEMBL11896274 0.80 HTR2A (0.41) HTR2ASIGMAR1TDP1OPRM1OPRK1
SCHEMBL27608809 0.80 HTR2A (0.41) HTR2ASIGMAR1TDP1OPRM1OPRK1
SCHEMBL17183733 0.80 HTR2A (0.41) HTR2ASIGMAR1TDP1OPRM1OPRK1
SCHEMBL17183673 0.80 HTR2A (0.41) HTR2ASIGMAR1TDP1OPRM1OPRK1
SCHEMBL17183791 0.80 HTR2A (0.41) HTR2ASIGMAR1TDP1OPRM1OPRK1
SCHEMBL17183756 0.80 HTR2A (0.41) HTR2ASIGMAR1TDP1OPRM1OPRK1
Hydrochloric Acid SCHEMBL11755782 0.80 HTR2A (0.81) HTR2AHRH1SIGMAR1LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4273849-A HALOGENATED POLYMER, ACRYLIC COPOLYMER EASTMAN KODAK COMPANY (US) 1981-06-16 US disclosed
US-4229513-A CHLORINATED POLYETHYLENE, AND COPOLYMER OF POLAR MONOMER AND SOLUBILIZING MONOMER EASTMAN KODAK COMPANY (US) 1980-10-21 US disclosed