Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5076170

CCOC(=O)OC(C)OC(=O)[C@H]1CC[C@H](CN)CC1.Cl

nearest known ligand 0.40

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
OPRK1 known ✓ P41145 1/20 0.33
KLKB1 known ✓ P03952 2/20 0.32
GAA known ✓ P10253 2/20 0.31
LMNA P02545 2/20 0.40
PLG P00747 1/20 0.40
PLAT P00750 1/20 0.40
MAPT P10636 2/20 0.35
F2 P00734 1/20 0.34
SOAT1 P35610 1/20 0.34
SYK P43405 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
CYP3A4 P08684 2/20 0.33
KDM4E B2RXH2 1/20 0.33
THRB P10828 1/20 0.33
HPGD P15428 1/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
ALDH1A1 P00352 2/20 0.32
F11 P03951 2/20 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 SCHEMBL5076171 1.00 LMNA (0.40) LMNAPLGPLATMAPTF2
SCHEMBL917427 0.99 LMNA (0.41) LMNAPLGPLATMAPTF2
SCHEMBL917430 0.99 LMNA (0.41) LMNAPLGPLATMAPTF2
Hydrochloric Acid SCHEMBL10977530 0.88 PLG (0.50) LMNAPLGPLATF2KLKB1
Hydrochloric Acid SCHEMBL10973896 0.86 PLG (0.42) LMNAPLGPLATF2SYK
Hydrochloric Acid SCHEMBL10973889 0.86 PLG (0.42) LMNAPLGPLATF2SYK
SCHEMBL10973838 0.82 PLG (0.44) LMNAPLGPLATF2SYK
SCHEMBL10973845 0.82 PLG (0.44) LMNAPLGPLATF2SYK
SCHEMBL10978935 0.81 PLG (0.46) LMNAPLGPLATF2TSHR
Hydrochloric Acid SCHEMBL1068668 0.80 PLG (0.52) LMNAPLGPLATMAPTF2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080171691-A1 Inhibition of invasive remodelling LUND LEIF ROGE 2008-07-17 US claimed
US-20050137121-A1 Inhibiting or abolishing the protein cleaving action of plasmin, and inhibiting or abolishing the protein cleaving action of a murine metalloprotease. LUND LEIF R (DK) 2005-06-23 US claimed
EP-0942746-B1 INHIBITION OF INVASIVE REMODELLING FONDEN TIL FREMME AF EKSPERIME (DK) 2005-03-16 EP claimed
US-20020099004-A1 Inhibition of invasive remodelling LUND LEIF ROGE (DK) 2002-07-25 US claimed
US-20080171691-A1 Inhibition of invasive remodelling LUND LEIF ROGE 2008-07-17 US disclosed
US-20050137121-A1 Inhibiting or abolishing the protein cleaving action of plasmin, and inhibiting or abolishing the protein cleaving action of a murine metalloprotease. LUND LEIF R (DK) 2005-06-23 US disclosed
EP-0942746-B1 INHIBITION OF INVASIVE REMODELLING FONDEN TIL FREMME AF EKSPERIME (DK) 2005-03-16 EP disclosed
US-20020099004-A1 Inhibition of invasive remodelling LUND LEIF ROGE (DK) 2002-07-25 US disclosed
EP-0942746-A1 INHIBITION OF INVASIVE REMODELLING FONDEN TIL FREMME AF EKSPERIMENTEL CANCERFORSKNING (DK) 1999-09-22 EP disclosed
WO-1998024474-A1 INHIBITION OF INVASIVE REMODELLING FONDEN TIL FREMME AF EKSPERIMENTEL CANCERFORSKNING (DK) 1998-06-11 WO disclosed
WO-1994015904-A1 NOVEL PROCESS AND INTERMEDIATES FOR THE PREPARATION OF PRODRUGS PHARMACIA AB (SE) 1994-07-21 WO disclosed
EP-0079872-B1 ANTIFIBRINOLYTICALLY ACTIVE COMPOUNDS KabiVitrum AB (SE) 1985-03-20 EP disclosed
US-4483867-A ANTIULCER AGENTS, ANTIEDEMIC AGENTS KABIVITRUM AB (SE) 1984-11-20 US disclosed
EP-0079872-A1 Antifibrinolytically active compounds KabiVitrum AB (SE) 1983-05-25 EP disclosed