Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2341007

CC(O)COCC(C)O.C[N+](C)(C)CC(O)COCC(O)C[N+](C)(C)C.Cl

nearest known ligand 0.50

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
CHRM2 known ✓ P08172 2/20 0.35
CHRM4 known ✓ P08173 2/20 0.35
CHRM1 known ✓ P11229 2/20 0.35
CHRM5 known ✓ P08912 1/20 0.34
CHRM3 known ✓ P20309 1/20 0.34
MAOA known ✓ P21397 1/20 0.31
SLC6A2 known ✓ P23975 1/20 0.31
HTR2C known ✓ P28335 1/20 0.31
HTR2B known ✓ P41595 1/20 0.31
SLC6A3 known ✓ Q01959 1/20 0.31
HSD17B10 Q99714 1/20 0.50
TDP1 Q9NUW8 1/20 0.38
MAPT P10636 3/20 0.37
KDM4E B2RXH2 1/20 0.37
SLC22A16 Q86VW1 1/20 0.37
MAPK1 P28482 1/20 0.36
TSHR P16473 2/20 0.35
TBXA2R P21731 1/20 0.35
LMNA P02545 3/20 0.34
SMN1; SMN2 Q16637 2/20 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
SCHEMBL3833772 0.98 HSD17B10 (0.52) HSD17B10TDP1MAPTKDM4ESLC22A16
Hydrochloric Acid SCHEMBL3032024 0.95 HSD17B10 (0.50) HSD17B10TDP1MAPTKDM4ESLC22A16
Hydrochloric Acid SCHEMBL2341008 0.95 HSD17B10 (0.50) HSD17B10TDP1MAPTKDM4ESLC22A16
Hydrochloric Acid SCHEMBL347524 0.90 MAPT (0.42) HSD17B10MAPTKDM4ESLC22A16TSHR
SCHEMBL1131168 0.87 MAPT (0.44) HSD17B10MAPTKDM4ESLC22A16TSHR
Hydrochloric Acid SCHEMBL146731 0.85 MAPT (0.48) HSD17B10MAPTKDM4ESLC22A16TSHR
SCHEMBL23560611 0.82 HSD17B10 (0.62) HSD17B10TDP1MAPTKDM4EMAPK1
SCHEMBL30368919 0.82 HSD17B10 (0.60) HSD17B10TDP1MAPTKDM4EMAPK1
Hydrochloric Acid SCHEMBL2341005 0.81 TDP1 (0.48) HSD17B10TDP1MAPTSLC22A16MAPK1
SCHEMBL5524685 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1636329-B1 LIQUID LAUNDRY DETERGENT COMPOSITION CONTAINING BORON-COMPATIBLE CATIONIC DIPOSITION AIDS PROCTER & GAMBLE (US) 2011-08-24 EP disclosed
US-7226900-B2 Liquid laundry detergent composition containing boron-compatible cationic deposition aids THE PROCTOR & GAMBLE COMPANY (US) 2007-06-05 US disclosed
EP-1636329-A1 LIQUID LAUNDRY DETERGENT COMPOSITION CONTAINING BORON-COMPATIBLE CATIONIC DIPOSITION AIDS THE PROCTER & GAMBLE COMPANY (US) 2006-03-22 EP disclosed
US-20040266653-A1 Liquid laundry detergent composition containing boron-compatible cationic deposition aids THE PROCTER & GAMBLE COMPANY 2004-12-30 US disclosed
WO-2004113484-A1 LIQUID LAUNDRY DETERGENT COMPOSITION CONTAINING BORON-COMPATIBLE CATIONIC DIPOSITION AIDS THE PROCTER & GAMBLE COMPANY (US) 2004-12-29 WO disclosed