Hydrochloric Acid

Hydrochloric Acid

SCHEMBL11228832

CN1CCN(c2ccccc2)C1=N.Cl

nearest known ligand 0.69

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
SIGMAR1 known ✓ Q99720 4/20 0.69
DRD2 known ✓ P14416 2/20 0.36
DRD3 known ✓ P35462 1/20 0.36
MAOA known ✓ P21397 1/20 0.35
MAOB known ✓ P27338 1/20 0.35
CHRNA7 known ✓ P36544 2/20 0.35
DDB1 known ✓ Q16531 1/20 0.35
CRBN known ✓ Q96SW2 1/20 0.35
CHRNA3 known ✓ P32297 1/20 0.34
MEN1 O00255 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
MAPT P10636 1/20 0.36
ATM Q13315 1/20 0.36
POLB P06746 1/20 0.36
CYP3A4 P08684 1/20 0.34
ALOX15 P16050 1/20 0.34
CHRNB2 P17787 1/20 0.34
NFKB1 P19838 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
SCHEMBL11174174 0.83 SIGMAR1 (1.00) SIGMAR1MEN1NPC1RAB9AKMT2A
SCHEMBL14199843 0.74 SIGMAR1 (0.82) SIGMAR1MEN1NPC1RAB9AKMT2A
SCHEMBL9607913 0.73 SIGMAR1 (0.48) SIGMAR1MEN1NPC1RAB9AKMT2A
SCHEMBL2234870 0.73 MEN1 (0.72) SIGMAR1MEN1NPC1RAB9AKMT2A
Hydrochloric Acid SCHEMBL7165426 0.72 SIGMAR1 (0.68) SIGMAR1MEN1NPC1RAB9AKMT2A
SCHEMBL13238421 0.71 SIGMAR1 (0.45) SIGMAR1MEN1NPC1RAB9AKMT2A
SCHEMBL20095543 0.71 SIGMAR1 (0.55) SIGMAR1MEN1NPC1RAB9AKMT2A
SCHEMBL7171911 0.69 SIGMAR1 (0.70) SIGMAR1MEN1NPC1RAB9AKMT2A
Azolimine SCHEMBL11606251 0.69 SIGMAR1 (0.48) SIGMAR1MEN1NPC1RAB9AKMT2A
SCHEMBL25753806 0.68 SIGMAR1 (0.42) SIGMAR1MEN1NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4327098-A Pharmaceutical compositions useful in the treatment of cardiovascular hypertension and containing 4-substituted-2-iminoimadazolidine compounds A. H. ROBINS COMPANY, INC. (US) 1982-04-27 US disclosed
US-4327108-A Methods useful in the treatment of cardiac arrhythmia using 4-substituted-2-iminoimidazolidine compounds A. H. ROBINS COMPANY, INC. (US) 1982-04-27 US disclosed
US-4327107-A Method useful in the treatment of sugar cataracts using 4-substituted-2-iminoimidazolidine compounds A. H. ROBINS COMPANY, INC. (US) 1982-04-27 US disclosed
US-4288447-A Antihyperglycemic 4-substituted 2-iminoimidazolidine compositions A. H. ROBINS COMPANY, INC. (US) 1981-09-08 US disclosed
US-4288591-A ANTIINFLAMMATORY, HYPOTENSIVE, HYPOGLYCEMIC A. H. ROBINS COMPANY, INC. (US) 1981-09-08 US disclosed
US-4247705-A HYPOTENSIVE, HYPOGLYCEMIC, ANTIINFLAMMATORY A. H. ROBINS COMPANY, INC. (US) 1981-01-27 US disclosed