Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3316045

CC1(C)CC(=O)CC(=O)C1.CC1(C)CC(=O)CC(=O)C1.CC1(C)CC(=O)CC(=O)C1.CC1(C)CC(=O)CC(=O)C1.CC1(C)CC(=O)CC(=O)C1.CC1(C)CC(=O)CC(=O)C1.Cl.Cl.Cl.Cl.Cl.Cl

nearest known ligand 0.45

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 11)

geneUniProtsupporting neighboursconfidence
MAOA known ✓ P21397 1/20 0.42
GAA known ✓ P10253 5/20 0.36
GLA known ✓ P06280 1/20 0.33
ALDH1A1 P00352 12/20 0.45
ALOX15 P16050 1/20 0.45
MAPT P10636 5/20 0.40
KDM4E B2RXH2 3/20 0.37
POLB P06746 2/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 2/20 0.33
KMT2A Q03164 1/20 0.32

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 SCHEMBL2838012 1.00 ALDH1A1 (0.45) ALDH1A1ALOX15MAOAMAPTKDM4E
SCHEMBL123127 0.97 ALDH1A1 (0.47) ALDH1A1ALOX15MAOAMAPTKDM4E
SCHEMBL9336430 0.97 ALDH1A1 (0.47) ALDH1A1ALOX15MAOAMAPTKDM4E
SCHEMBL309527 0.94 ALDH1A1 (0.45) ALDH1A1ALOX15MAOAMAPTKDM4E
Iodide SCHEMBL2127044 0.94 ALDH1A1 (0.45) ALDH1A1ALOX15MAOAMAPTKDM4E
SCHEMBL9413813 0.94 ALDH1A1 (0.45) ALDH1A1ALOX15MAOAMAPTKDM4E
Hydrogen Sulfide SCHEMBL3121740 0.94 ALDH1A1 (0.45) ALDH1A1ALOX15MAOAMAPTKDM4E
Bromide SCHEMBL7687601 0.94 ALDH1A1 (0.45) ALDH1A1ALOX15MAOAMAPTKDM4E
Bromide SCHEMBL16332561 0.94 ALDH1A1 (0.45) ALDH1A1ALOX15MAOAMAPTKDM4E
Water SCHEMBL4753900 0.94 ALDH1A1 (0.45) ALDH1A1ALOX15MAOAMAPTKDM4E

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
US-8445651-B2 Method for producing charge control agent and toner HUBEI DINGLONG CHEMICAL CO., LTD. (CN) 2013-05-21 US disclosed
CN-101387836-B Method for preparing electronic charge regulating agent HUBEI DINGLONG CHEMICAL CO LTD 2011-05-25 CN disclosed
US-20100105884-A1 METHOD FOR PRODUCING CHARGE CONTROL AGENT AND TONER HUBEI DINGLONG CHEMICAL CO., LTD. (CN) 2010-04-29 US disclosed
CN-101387836-A Method for preparing electronic charge regulating agent and carbon powder HUBEI DINGLONG CHEMICAL CO LTD (CN) 2009-03-18 CN disclosed