Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5048328

CC1(C)CC(NCCNCCNCCNC2CC(C)(C)N(O)C(C)(C)C2)CC(C)(C)N1O.Cl.Cl.Cl.Cl.Cl.Cl

nearest known ligand 0.42

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 4)

geneUniProtsupporting neighboursconfidence
GAA known ✓ P10253 3/20 0.42
KDM4E B2RXH2 2/20 0.42
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL2962376 0.98 GAA (0.40) GAAKDM4EKMT2AL3MBTL1
SCHEMBL5400361 0.98 GAA (0.40) GAAKDM4EKMT2AL3MBTL1
SCHEMBL13202057 0.90 CA12 (0.37) GAAKDM4EKMT2AL3MBTL1
SCHEMBL18329616 0.82 GAA (0.40) GAAKDM4EKMT2AL3MBTL1
SCHEMBL2963209 0.82 GAA (0.40) GAAKDM4EKMT2AL3MBTL1
SCHEMBL5697706 0.81 GAA (0.39) GAAKDM4EKMT2AL3MBTL1
SCHEMBL10641476 0.80
SCHEMBL870336 0.79 GAA (0.38) GAAKDM4EKMT2AL3MBTL1
SCHEMBL7044879 0.78 GBA1 (0.43) GAAKDM4EKMT2A
SCHEMBL17517789 0.78 GAA (0.40) GAAKDM4EKMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7384504-B2 Light-stable and process-stable lignocellulosic materials and their production FPINNOVATIONS (CA) 2008-06-10 US claimed
US-20050269049-A1 Light-stable and process-stable lignocellulosic materials and their production PULP AND PAPER RESEARCH INSTITUTE OF CANADA (CA) 2005-12-08 US claimed
WO-2004038091-A1 LIGHT-STABLE AND PROCESS-STABLE LIGNOCELLULOSIC MATERIALS AND THEIR PRODUCTION PULP AND PAPER RESEARCH INSTITUTE OF CANADA (CA) 2004-05-06 WO claimed
US-7384504-B2 Light-stable and process-stable lignocellulosic materials and their production FPINNOVATIONS (CA) 2008-06-10 US disclosed
US-7384504-B2 Light-stable and process-stable lignocellulosic materials and their production FPINNOVATIONS (CA) 2008-06-10 US disclosed
US-20050269049-A1 Light-stable and process-stable lignocellulosic materials and their production PULP AND PAPER RESEARCH INSTITUTE OF CANADA (CA) 2005-12-08 US disclosed
US-20050269049-A1 Light-stable and process-stable lignocellulosic materials and their production PULP AND PAPER RESEARCH INSTITUTE OF CANADA (CA) 2005-12-08 US disclosed
WO-2004038091-A1 LIGHT-STABLE AND PROCESS-STABLE LIGNOCELLULOSIC MATERIALS AND THEIR PRODUCTION PULP AND PAPER RESEARCH INSTITUTE OF CANADA (CA) 2004-05-06 WO disclosed
WO-2004038091-A1 LIGHT-STABLE AND PROCESS-STABLE LIGNOCELLULOSIC MATERIALS AND THEIR PRODUCTION PULP AND PAPER RESEARCH INSTITUTE OF CANADA (CA) 2004-05-06 WO disclosed