Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4083238

Cl.Cl.N=C(N)NCCC[C@H](N)C(=O)Nc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.45

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
GLA known ✓ P06280 3/20 0.44
GAA known ✓ P10253 1/20 0.41
CA2 known ✓ P00918 1/20 0.41
MMP2 P08253 1/20 0.45
ALDH1A1 P00352 5/20 0.44
MAPT P10636 5/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
LMNA P02545 3/20 0.44
HTT P42858 3/20 0.44
HPGD P15428 1/20 0.44
ALOX12 P18054 1/20 0.44
KMT2A Q03164 5/20 0.44
MEN1 O00255 4/20 0.44
NPSR1 Q6W5P4 1/20 0.43
POLB P06746 2/20 0.42
KDM4E B2RXH2 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA4 P22748 1/20 0.41
CA7 P43166 1/20 0.41

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 SCHEMBL1821105 1.00 MMP2 (0.45) MMP2ALDH1A1MAPTSMN1; SMN2GLA
Hydrochloric Acid SCHEMBL5498773 1.00 MMP2 (0.45) MMP2ALDH1A1MAPTSMN1; SMN2GLA
SCHEMBL1663791 0.99 MMP2 (0.46) MMP2ALDH1A1MAPTSMN1; SMN2GLA
SCHEMBL10448234 0.99 MMP2 (0.46) MMP2ALDH1A1MAPTSMN1; SMN2GLA
Acetic Acid SCHEMBL11421148 0.94 ALDH1A1 (0.46) MMP2ALDH1A1MAPTSMN1; SMN2GLA
SCHEMBL16446037 0.90 PDF (0.50) MMP2ALDH1A1MAPTSMN1; SMN2GLA
SCHEMBL30999020 0.89 ALDH1A1 (0.44) MMP2ALDH1A1MAPTSMN1; SMN2GLA
Hydrochloric Acid SCHEMBL4449414 0.87 PDF (0.44) MMP2ALDH1A1MAPTSMN1; SMN2GLA
SCHEMBL7601781 0.86 MMP2 (0.43) MMP2ALDH1A1MAPTSMN1; SMN2GLA
SCHEMBL5582797 0.86 PDF (0.44) MMP2ALDH1A1MAPTSMN1; SMN2GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-63045299-A None JP disclosed
JP-63051400-A None JP disclosed
WO-2023075435-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE 주식회사 베르티스 2023-05-04 WO disclosed
US-20220283131-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTES BERTIS CO., LTD. (KR) 2022-09-08 US disclosed
WO-2022050529-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE ㈜베르티스 2022-03-10 WO disclosed
EP-2358874-B1 SERINE PROTEASE DERIVATIVES AND USES IN THE PREVENTION OR THE TREATMENT OF BLOOD COAGULATION DISORDERS INSERM (INSTITUT NAT DE LA SANTÉ ET DE LA RECH MÉDICALE) (FR) 2017-03-29 EP disclosed
US-20130101570-A1 SERINE PROTEASE DERIVATIVES AND USES IN THE PREVENTION OR THE TREATMENT OF BLOOD COAGULATION DISORDERS Institut National de la Sante et de la Recherche Mediclae (INSERM) (FR) 2013-04-25 US disclosed
EP-2022494-A2 Laxative preparation containing l-Arginine Norgine BV (NL) 2009-02-11 EP disclosed
EP-1251844-B1 LAXATIVE PREPARATION CONTAINING L-ARGININE NORGINE BV (NL) 2008-12-03 EP disclosed
US-20050080137-A1 Laxative preparation PRESIDENT AND FELLOWS OF HARVARD COLLEGE 2005-04-14 US disclosed
JP-S6345299-A PEPTIDE DERIVATIVE DAI ICHI PURE CHEM CO LTD 1988-02-26 JP disclosed
EP-0137742-B1 PROCESS FOR PRODUCING ARGINYL-P-NITROANILIDE NITTO BOSEKI CO., LTD. (JP) 1986-09-17 EP disclosed
US-4564695-A Process for producing arginyl-p-nitroanilide NITTO BOSEKI CO., LTD. (JP) 1986-01-14 US disclosed
EP-0074761-B1 PEPTIDE-TYPE SUBSTRATES USEFUL IN THE QUANTITATIVE DETERMINATION OF ENDOTOXIN WHITTAKER CORPORATION (US) 1985-12-27 EP disclosed
EP-0137742-A1 Process for producing arginyl-p-nitroanilide NITTO BOSEKI CO., LTD. (JP) 1985-04-17 EP disclosed
US-4510241-A BASED ON AXCTIVATING A PROCLOTTIN ENZYME FROM AN AMOEBA FROM HORSE MALLINCKRODT, INC. (US) 1985-04-09 US disclosed
US-4406832-A Peptide-type substrates useful in the quantitative determination of endotoxin MALLINCKRODT, INC. (US) 1983-09-27 US disclosed
EP-0074761-A1 Peptide-type substrates useful in the quantitative determination of endotoxin WHITTAKER CORPORATION (US) 1983-03-23 EP disclosed
US-4217269-A FOR SPECTROPHOTOMETRIC MEASUREMENT OF PROTEOLYTIC ENZYMES ABBOTT LABORATORIES (US) 1980-08-12 US disclosed
JP-S06345299-A 0001-01-01 JP disclosed