Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7287043

Cc1ccc(CCCN2CCN(CCOCc3ccc(Cl)cc3)CC2)cc1.Cl.Cl

nearest known ligand 0.56

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 0.56
▸ HRH1 known ✓ P35367 3/20 0.56
▸ HRH3 known ✓ Q9Y5N1 3/20 0.56
▸ SLC6A2 known ✓ P23975 2/20 0.56
▸ HTR2C known ✓ P28335 2/20 0.56
▸ CHRM4 known ✓ P08173 1/20 0.56
▸ HTR7 known ✓ P34969 1/20 0.56
▸ CHRM2 known ✓ P08172 1/20 0.54
▸ ADRA2C known ✓ P18825 1/20 0.54
▸ SLC6A4 known ✓ P31645 1/20 0.54
▸ SLC6A3 known ✓ Q01959 1/20 0.54
▸ KCNH2 known ✓ Q12809 1/20 0.54
▸ CACNA1C known ✓ Q13936 1/20 0.54
▸ SCN5A known ✓ Q14524 1/20 0.54
▸ GAA known ✓ P10253 2/20 0.47
▸ DRD2 known ✓ P14416 2/20 0.45
▸ HTR1A known ✓ P08908 1/20 0.45
▸ DRD1 known ✓ P21728 1/20 0.45
▸ HTR2A known ✓ P28223 1/20 0.45
▸ DRD3 known ✓ P35462 1/20 0.45

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 SCHEMBL7280212 0.88 SIGMAR1 (0.59) SIGMAR1SLC6A2HTR7SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL7288768 0.87 SLC6A4 (0.54) SIGMAR1HRH1SLC6A2HTR2CHTR7
Hydrochloric Acid SCHEMBL7286306 0.80 DRD2 (0.66) SIGMAR1HRH3SMN1; SMN2ALDH1A1DRD2
Hydrochloric Acid SCHEMBL467279 0.79 SIGMAR1 (0.71) SIGMAR1HRH3SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL10503180 0.78 SIGMAR1 (0.62) SIGMAR1HRH1HRH3SLC6A2TMEM97
SCHEMBL10502864 0.78 SIGMAR1 (0.66) SIGMAR1HRH1HRH3SLC6A2TMEM97
SCHEMBL5708578 0.77 SIGMAR1 (0.73) SIGMAR1HRH3SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL9871597 0.77 SIGMAR1 (0.53) SIGMAR1SLC6A2HTR7SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL7289371 0.77 SMN1; SMN2 (0.52) SIGMAR1HRH1HTR7KCNH2SMN1; SMN2
Hydrochloric Acid SCHEMBL9647738 0.77 SIGMAR1 (0.55) SIGMAR1SLC6A2HTR7SLC6A4SLC6A3

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-5281598-A Psychological disorders AKZO N.V. (NL) 1994-01-25 — — US disclosed
EP-0566189-A1 Psychotropic piperazine derivative AKZO N.V. (NL) 1993-10-20 — — EP disclosed
Send feedback