Hydrochloric Acid

Hydrochloric Acid

SCHEMBL1499448

Cc1ccc(N[C@@H](Cc2ccccc2)C(=O)O)cc1.Cl.O=CCCl

nearest known ligand 0.47

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 12)

geneUniProtsupporting neighboursconfidence
PPARG known ✓ P37231 2/20 0.47
GAA known ✓ P10253 1/20 0.45
MMP9 P14780 1/20 0.47
MAPT P10636 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
FPR2 P25090 7/20 0.43
MAPK1 P28482 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
ITGB1 P05556 2/20 0.43
ITGA4 P13612 2/20 0.43
NPR3 P17342 1/20 0.42
ATM Q13315 1/20 0.42

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
SCHEMBL10690475 0.99 MMP9 (0.48) MMP9PPARGGAAMAPTL3MBTL1
SCHEMBL10692667 0.89 PPARG (0.55) MMP9PPARGGAAMAPTL3MBTL1
SCHEMBL7100965 0.89 PPARG (0.55) MMP9PPARGGAAMAPTL3MBTL1
SCHEMBL21373232 0.87 PPARG (0.49) MMP9PPARGGAAMAPTL3MBTL1
SCHEMBL21373234 0.87 PPARG (0.49) MMP9PPARGGAAMAPTL3MBTL1
SCHEMBL10690468 0.87 PPARG (0.51) MMP9PPARGGAAMAPTL3MBTL1
SCHEMBL10690483 0.87 PPARG (0.51) MMP9PPARGGAAMAPTL3MBTL1
SCHEMBL4565010 0.81 CTSG (0.50) MMP9PPARGGAAMAPTL3MBTL1
SCHEMBL2957410 0.81 CTSG (0.50) MMP9PPARGGAAMAPTL3MBTL1
SCHEMBL2957409 0.80 GAA (0.48) MMP9PPARGGAAMAPTL3MBTL1

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8268604-B2 Compositions for forming immobilized biological layers for sensing ABBOTT POINT OF CARE INC. (US) 2012-09-18 US claimed
JP-2011508221-A 2011-03-10 JP claimed
US-20100255120-A1 COMPOSITIONS FOR FORMING IMMOBILIZED BIOLOGICAL LAYERS FOR SENSING ABBOTT POINT OF CARE INC. 2010-10-07 US claimed
EP-2225388-A1 COMPOSITIONS FOR FORMING IMMOBIIZED BIOLOGICAL LAYERS FOR SENSING Abbott Point Of Care, Inc. (US) 2010-09-08 EP claimed
WO-2009082699-A1 COMPOSITIONS FOR FORMING IMMOBIIZED BIOLOGICAL LAYERS FOR SENSING I-STAT CORPORATION (US) 2009-07-02 WO claimed
US-9441259-B2 Formation of immobilized biological layers for sensing ABBOTT POINT OF CARE INC. (US) 2016-09-13 US disclosed
EP-2225388-B1 COMPOSITIONS FOR FORMING IMMOBILIZED BIOLOGICAL LAYERS FOR SENSING ABBOTT POINT OF CARE INC (US) 2016-03-30 EP disclosed
US-20150275261-A1 FORMATION OF IMMOBILIZED BIOLOGICAL LAYERS FOR SENSING ABBOTT POINT OF CARE INC. (US) 2015-10-01 US disclosed
US-8986526-B2 Formation of immobilized biological layers for sensing ABBOTT POINT OF CARE INC. (US) 2015-03-24 US disclosed
EP-2235513-B1 FORMATION OF IMMOBILIZED BIOLOGICAL LAYERS FOR SENSING ABBOTT POINT OF CARE INC (US) 2014-05-07 EP disclosed
US-20130112558-A1 FORMATION OF IMMOBILIZED BIOLOGICAL LAYERS FOR SENSING ABBOTT POINT OF CARE INC. (US) 2013-05-09 US disclosed
US-8389042-B2 Formation of immobilized biological layers for sensing ABBOTT POINT OF CARE INC. (US) 2013-03-05 US disclosed
US-8268604-B2 Compositions for forming immobilized biological layers for sensing ABBOTT POINT OF CARE INC. (US) 2012-09-18 US disclosed
US-8241697-B2 Formation of immobilized biological layers for sensing ABBOTT POINT OF CARE INC. (US) 2012-08-14 US disclosed
US-20100255120-A1 COMPOSITIONS FOR FORMING IMMOBILIZED BIOLOGICAL LAYERS FOR SENSING ABBOTT POINT OF CARE INC. 2010-10-07 US disclosed
EP-2235513-A1 FORMATION OF IMMOBILIZED BIOLOGICAL LAYERS FOR SENSING Abbott Point Of Care, Inc. (US) 2010-10-06 EP disclosed
EP-2225388-A1 COMPOSITIONS FOR FORMING IMMOBIIZED BIOLOGICAL LAYERS FOR SENSING Abbott Point Of Care, Inc. (US) 2010-09-08 EP disclosed
WO-2009105145-A1 FORMATION OF IMMOBILIZED BIOLOGICAL LAYERS FOR SENSING I-STAT CORPORATION (US) 2009-08-27 WO disclosed
WO-2009082699-A1 COMPOSITIONS FOR FORMING IMMOBIIZED BIOLOGICAL LAYERS FOR SENSING I-STAT CORPORATION (US) 2009-07-02 WO disclosed
US-20090159442-A1 FORMATION OF IMMOBILIZED BIOLOGICAL LAYERS FOR SENSING ABBOTT POINT OF CARE INC. 2009-06-25 US disclosed