Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7146324

COc1ccc(N2CCN(CCNc3ccc4ccccc4n3)CC2)cc1.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 14)

geneUniProtsupporting neighboursconfidence
HTR1A known ✓ P08908 12/20 0.69
SLC6A2 known ✓ P23975 1/20 0.61
SLC6A4 known ✓ P31645 1/20 0.61
DRD2 known ✓ P14416 3/20 0.59
ADRA1A known ✓ P35348 2/20 0.59
DRD3 known ✓ P35462 2/20 0.59
GAA known ✓ P10253 1/20 0.52
HTR7 known ✓ P34969 1/20 0.51
LMNA P02545 1/20 0.52
MAPT P10636 1/20 0.52
GFER P55789 1/20 0.52
POLB P06746 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL7144879 0.99 HTR1A (0.70) HTR1ASLC6A2SLC6A4DRD2ADRA1A
SCHEMBL27343629 0.88 HTR1A (0.67) HTR1ADRD2ADRA1ADRD3HTR7
SCHEMBL8011275 0.81 HTR1A (1.00) HTR1ADRD2ADRA1ADRD3
SCHEMBL977564 0.80 DRD2 (0.58) HTR1ADRD2ADRA1ADRD3MAPT
SCHEMBL11784383 0.80 SLC6A2 (0.59) HTR1ASLC6A2SLC6A4DRD2ADRA1A
Bromide SCHEMBL7207014 0.78 DRD2 (0.67) HTR1ASLC6A4DRD2ADRA1ADRD3
SCHEMBL28309631 0.77 HTR1A (0.62) HTR1ADRD2ADRA1ADRD3
SCHEMBL7212266 0.77 HTR1A (0.64) HTR1ASLC6A2SLC6A4DRD2ADRA1A
Bromide SCHEMBL7212285 0.76 HTR1A (0.62) HTR1ASLC6A2SLC6A4DRD2ADRA1A
SCHEMBL7888415 0.76 GAA (0.54) HTR1ASLC6A2SLC6A4LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1054863-B1 2-AMINOQUINOLINE DERIVATIVES HAVING D4-AGONISTIC ACTIVITY DUPHAR INT RES (NL) 2003-05-07 EP disclosed
US-6281216-B1 2-aminoquinoline derivatives having d4-agonistic activity DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 2001-08-28 US disclosed
EP-1054863-A2 2-AMINOQUINOLINE DERIVATIVES HAVING D4-AGONISTIC ACTIVITY DUPHAR INTERNATIONAL RESEARCH B.V (NL) 2000-11-29 EP disclosed
WO-1999040068-A2 2-AMINOQUINOLINE DERIVATIVES HAVING D4-AGONISTIC ACTIVITY DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1999-08-12 WO disclosed