Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2044745

Cl.N=C(N)NCCCC(NC(=O)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1

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
HDAC4 known ✓ P56524 4/20 0.43
HDAC3 known ✓ O15379 4/20 0.42
HDAC1 known ✓ Q13547 4/20 0.42
HDAC7 known ✓ Q8WUI4 3/20 0.42
HDAC2 known ✓ Q92769 3/20 0.42
HDAC10 known ✓ Q969S8 3/20 0.42
HDAC11 known ✓ Q96DB2 3/20 0.42
HDAC8 known ✓ Q9BY41 3/20 0.42
HDAC6 known ✓ Q9UBN7 3/20 0.42
HDAC9 known ✓ Q9UKV0 3/20 0.42
HDAC5 known ✓ Q9UQL6 3/20 0.42
GRIN1 known ✓ Q05586 1/20 0.40
GRIN2A known ✓ Q12879 1/20 0.40
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
MITF O75030 1/20 0.50
POLB P06746 1/20 0.50
PDF Q9HBH1 1/20 0.45

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 SCHEMBL10768387 1.00 NPC1 (0.50) NPC1RAB9AMEN1KMT2AMITF
Hydrochloric Acid SCHEMBL593062 1.00 NPC1 (0.50) NPC1RAB9AMEN1KMT2AMITF
SCHEMBL701212 0.99 NPC1 (0.51) NPC1RAB9AMEN1KMT2AMITF
SCHEMBL2936175 0.99 NPC1 (0.51) NPC1RAB9AMEN1KMT2AMITF
SCHEMBL591280 0.99 NPC1 (0.51) NPC1RAB9AMEN1KMT2AMITF
SCHEMBL7888177 0.90 PDF (0.45) NPC1RAB9AMEN1KMT2AMITF
SCHEMBL5576719 0.88 KISS1R (0.46) NPC1RAB9AMEN1KMT2AMITF
SCHEMBL8002080 0.88 NPC1 (0.42) NPC1RAB9AMEN1KMT2AMITF
Hydrochloric Acid SCHEMBL5847438 0.88 NPC1 (0.40) NPC1RAB9AMEN1KMT2AMITF
Hydrochloric Acid SCHEMBL566787 0.87 SSTR3 (0.51) NPC1RAB9ASSTR3SMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12564636-B2 Pnictogen-containing heterocyclic compounds and their use UNIVERSITY OF RHODE ISLAND BOARD OF TRUSTEES (US) 2026-03-03 US disclosed
US-20240285772-A1 PNICTOGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND THEIR USE COLGATE UNIVERSITY 2024-08-29 US 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
CN-113908157-B Application of nicotinamide in preparation of anti-porphyromonas gingivalis medicine 四川大学 2022-08-30 CN disclosed
WO-2022050529-A1 COMPOSITION FOR DETECTING OR MEASURING ANALYTE ㈜베르티스 2022-03-10 WO disclosed
CN-113908157-A Application of nicotinamide in preparation of anti-porphyromonas gingivalis medicine 四川大学 2022-01-11 CN disclosed
EP-2506877-B1 THERAPIES FOR PREVENTING OR SUPPRESSING CLOSTRIDIUM DIFFICILE INFECTION SEC DEP FOR HEALTH AND SOCIAL CARE (GB) 2021-08-04 EP disclosed
US-20200345032-A1 Enzymatic-Based Process for the Extraction of Value Added Products from Raw Biomasses NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2020-11-05 US disclosed
EP-3614857-A1 ENZYMATIC-BASED PROCESS FOR THE EXTRACTION OF VALUE ADDED PRODUCTS FROM RAW BIOMASSES National Research Council of Canada (CA) 2020-03-04 EP disclosed
EP-2054514-A2 ENZYME SENSORS, METHODS FOR PREPARING AND USING SUCH SENSORS, AND METHODS OF DETECTING PROTEASE ACTIVITY Georgia State University Research Foundation, Inc. (US) 2009-05-06 EP disclosed
US-20080268497-A1 Using mixture comprising digestive enzyme and gold particles to prepare tissue for mass spectrum proteomic analysis CANON KABUSHIKI KAISHA (JP) 2008-10-30 US disclosed
WO-2008019123-A2 ENZYME SENSORS, METHODS FOR PREPARING AND USING SUCH SENSORS, AND METHODS OF DETECTING PROTEASE ACTIVITY GEORGIA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2008-02-14 WO disclosed
WO-2006060774-A2 AGENTS THAT INHIBIT FLAVIVIRUS REPLICATION AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2006-06-08 WO disclosed
US-5185246-A Using membrane with specific pore size to trap particles and pass seminal plasma DEUTSCH ALICE (US) 1993-02-09 US disclosed
US-5075335-A Enzyme inhibitors EISAI CO., LTD. (JP) 1991-12-24 US disclosed
US-5028526-A Applying to a membrane which allows plasma to pass through and retains the particles Deutsch, Alice (US) 1991-07-02 US disclosed
US-4948808-A ENZYME INHIBITORS EISAI CO., LTD. (JP) 1990-08-14 US disclosed
EP-0229370-B1 GUANIDINOBENZOIC ESTER DERIVATIVE, A PROCESS FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME Eisai Co., Ltd. (JP) 1989-04-19 EP disclosed
US-4801603-A ENZYME INHIBITORS, TREATMENT OF PANCREATITIS, HEMORRHAGE, THROMBOSIS EISAI CO., LTD. (JP) 1989-01-31 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 (2 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-12564636-B2 Pnictogen-containing heterocyclic compounds and their use CBR1, PNPO, NOX3 HDAC4 3886/4885HDAC3 1125/4885HDAC1 2890/4885
US-20240285772-A1 PNICTOGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND THEIR USE PYGL, UGT2B7, CYP2E1 HDAC4 3132/4885HDAC3 1162/4885HDAC1 1253/4885

“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.