Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2595284

CN(C)C(CCCNC(=N)N)C(=O)O.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 20)

geneUniProtsupporting neighboursconfidence
GAA known ✓ P10253 1/20 0.34
ITGB3 known ✓ P05106 1/20 0.31
ITGA2B known ✓ P08514 1/20 0.31
CHRNB4 known ✓ P30926 1/20 0.31
NOS3 P29474 1/20 0.37
NOS1 P29475 1/20 0.37
NOS2 P35228 1/20 0.37
ALOX15 P16050 1/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CYP1A2 P05177 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
OTC P00480 1/20 0.33
FOLH1 Q04609 2/20 0.32
ALB P02768 1/20 0.32
DDAH1 O94760 1/20 0.31
SPHK1 Q9NYA1 3/20 0.31
CHRNB2 P17787 1/20 0.31
CHRNA4 P43681 1/20 0.31
NPY4R P50391 2/20 0.30

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 SCHEMBL12078158 1.00 NOS3 (0.37) NOS3NOS1NOS2ALOX15MEN1
Hydrochloric Acid SCHEMBL12078437 1.00 NOS3 (0.37) NOS3NOS1NOS2ALOX15MEN1
Hydrochloric Acid SCHEMBL2595285 1.00 NOS3 (0.37) NOS3NOS1NOS2ALOX15MEN1
SCHEMBL29770073 0.98 NOS2 (0.38) NOS3NOS1NOS2ALOX15MEN1
SCHEMBL196827 0.98 NOS2 (0.38) NOS3NOS1NOS2ALOX15MEN1
SCHEMBL160690 0.98 NOS2 (0.38) NOS3NOS1NOS2ALOX15MEN1
SCHEMBL288819 0.98 NOS2 (0.38) NOS3NOS1NOS2ALOX15MEN1
SCHEMBL995563 0.98 NOS2 (0.38) NOS3NOS1NOS2ALOX15MEN1
Dimethylamine SCHEMBL27821422 0.95 NOS3 (0.36) NOS3NOS1NOS2ALOX15MEN1
SCHEMBL1697811 0.94 ALOX15 (0.38) NOS3NOS1NOS2ALOX15MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3041576-B1 METHODS FOR DETECTING RENAL DISEASE IDEXX LAB INC (US) 2019-06-19 EP disclosed
US-20180335423-A1 Methods for Detecting Symmetrical Dimethylarginine IDEXX LAB INC (US) 2018-11-22 US disclosed
CN-108333271-A Asymmetric dimethylarginine efficient detection method 杭州佰辰医学检验所有限公司 2018-07-27 CN disclosed
US-9970927-B2 Methods for detecting symmetrical dimethylarginine IDEXX LABORATORIES, INC. (US) 2018-05-15 US disclosed
US-9091684-B2 Methods for detecting symmetrical dimethylarginine IDEXX LABORATORIES, INC. (US) 2015-07-28 US disclosed
US-20140242723-A1 Methods for Detecting Symmetrical Dimethylarginine IDEXX LABORATORIES, INC. (US) 2014-08-28 US disclosed
US-20130280740-A1 Methods for Detecting Symmetrical Dimethylarginine IDEXX LABORATORIES, INC. 2013-10-24 US disclosed
US-8481690-B2 Methods for detecting symmetrical dimethylarginine IDEXX LABORATORIES, INC. (US) 2013-07-09 US disclosed
EP-2566510-A1 COMPOSITIONS AND METHODS USEFUL FOR REDUCING THE VISCOSITY OF PROTEIN-CONTAINING FORMULATIONS F. Hoffmann-La Roche AG (CH) 2013-03-13 EP disclosed
WO-2011139718-A1 COMPOSITIONS AND METHODS USEFUL FOR REDUCING THE VISCOSITY OF PROTEIN-CONTAINING FORMULATIONS GENENTECH, INC. (US) 2011-11-10 WO disclosed
US-20100035274-A1 Methods for Detecting Symmetrical Dimethylarginine IDEXX LABORATORIES, INC. 2010-02-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130280740-A1 Methods for Detecting Symmetrical Dimethylarginine PADI2, PADI1, PRMT3 GAA 4068/4885ITGB3 3105/4885ITGA2B 3439/4885
US-20180335423-A1 Methods for Detecting Symmetrical Dimethylarginine PADI2, PADI1, PRMT3 GAA 4068/4885ITGB3 3105/4885ITGA2B 3439/4885
US-20100035274-A1 Methods for Detecting Symmetrical Dimethylarginine PADI2, PADI1, PRMT3 GAA 4068/4885ITGB3 3105/4885ITGA2B 3439/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.