Hydrochloric Acid

Hydrochloric Acid

SCHEMBL29793967

Cl.Cl.N=C(N)NCCC[C@H](NC(=O)[C@@H]1CCCCN1C(=O)[C@H](N)Cc1ccccc1)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 8)

geneUniProtsupporting neighboursconfidence
OPRM1 known ✓ P35372 5/20 0.45
OPRD1 known ✓ P41143 2/20 0.45
OPRK1 known ✓ P41145 2/20 0.45
TACR1 known ✓ P25103 1/20 0.44
NPFFR1 Q9GZQ6 2/20 0.45
NPFFR2 Q9Y5X5 2/20 0.45
FKBP4 Q02790 1/20 0.44
F2 P00734 1/20 0.44

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
SCHEMBL29442961 0.99 OPRM1 (0.45) OPRM1NPFFR1NPFFR2OPRD1OPRK1
SCHEMBL7586649 0.97 OPRM1 (0.47) OPRM1NPFFR1NPFFR2OPRD1OPRK1
SCHEMBL30561151 0.97 OPRM1 (0.47) OPRM1NPFFR1NPFFR2OPRD1OPRK1
SCHEMBL29387566 0.88 F2 (0.57) OPRM1NPFFR1NPFFR2OPRD1OPRK1
SCHEMBL497331 0.87 FKBP4 (0.43) OPRM1NPFFR1NPFFR2OPRD1OPRK1
Hydrochloric Acid SCHEMBL7752557 0.86 FKBP4 (0.48) OPRM1NPFFR1NPFFR2OPRD1OPRK1
SCHEMBL5704652 0.86 FKBP4 (0.48) OPRM1NPFFR1NPFFR2OPRD1OPRK1
SCHEMBL6049428 0.85 NTSR2 (0.48) OPRM1NPFFR1NPFFR2OPRD1
Acetic Acid SCHEMBL3281925 0.85 FKBP4 (0.48) OPRM1OPRD1OPRK1TACR1FKBP4
SCHEMBL30831830 0.85 F2 (0.59) OPRM1NPFFR1NPFFR2OPRD1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114921447-B Preparation method of enzyme reagent and prothrombin time detection card containing enzyme reagent 可孚医疗科技股份有限公司 2023-12-12 CN claimed
CN-116718776-A Detect alpha 2 Macroglobulin kit 希肯生物技术(苏州)有限公司 2023-09-08 CN claimed
CN-112662735-B Antithrombin III activity determination kit and preparation method thereof 北京美创新跃医疗器械有限公司 2022-10-14 CN claimed
US-12618841-B2 Methods of diagnosing malignant diseases ST INNOVATIVE DIAGNOSTICS LTD (IL) 2026-05-05 US disclosed
CN-118239923-A Compounds useful as inhibitors of factor XIIa, pharmaceutical compositions and uses thereof 合肥工业大学 2024-06-25 CN disclosed
CN-115677850-B Hirudo gene mutant hirudin with strong anticoagulation activity and preparation method thereof 王大勇 2024-03-08 CN disclosed
CN-115572329-B Poecilobdella manillensis gene recombinant hirudin with slower activity enhancement metabolism and preparation method thereof 王大勇 2024-02-06 CN disclosed
CN-114921447-B Preparation method of enzyme reagent and prothrombin time detection card containing enzyme reagent 可孚医疗科技股份有限公司 2023-12-12 CN disclosed
CN-116908476-A Method for diagnosing malignant disease ST创新诊断有限公司 2023-10-20 CN disclosed
CN-110234997-B Method for diagnosing malignant disease ST创新诊断有限公司 2023-06-16 CN disclosed
US-20230109120-A1 METHODS OF DIAGNOSING MALIGNANT DISEASES ST INNOVATIVE DIAGNOSTICS LTD (IL) 2023-04-06 US disclosed
CN-115677850-A Hirudin with strong anticoagulation activity and gene mutation and preparation method thereof 王大勇 2023-02-03 CN disclosed
CN-115586179-A Kit for determining activity of antithrombin III and application thereof 深圳市帝迈生物技术有限公司 2023-01-10 CN disclosed
CN-115572329-A Poecilobdella manillensis gene recombinant hirudin with slow activity enhancement and metabolism and preparation method thereof 王大勇 2023-01-06 CN disclosed
CN-112662735-B Antithrombin III activity determination kit and preparation method thereof 北京美创新跃医疗器械有限公司 2022-10-14 CN disclosed
CN-114921447-A Preparation method of enzyme reagent and prothrombin time detection card containing enzyme reagent 可孚医疗科技股份有限公司 2022-08-19 CN 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 (1 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-12618841-B2 Methods of diagnosing malignant diseases FGB, F2, TFPI2 OPRM1 4826/4885OPRD1 4793/4885OPRK1 4746/4885

“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.