Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2762373

COC(=O)C(N)CCCNC(=N)N.Cl

nearest known ligand 0.46

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
RRM1 known ✓ P23921 1/20 0.34
NPY4R P50391 7/20 0.44
NPY1R P25929 5/20 0.44
DPP7 Q9UHL4 2/20 0.40
NPY2R P49146 4/20 0.37
NPY5R Q15761 4/20 0.37
OTC P00480 1/20 0.36
ALOX15 P16050 1/20 0.36
GNAI3 P08754 1/20 0.36
GNAO1 P09471 1/20 0.36
GNAI1 P63096 1/20 0.36
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
NOS2 P35228 1/20 0.35
TSHR P16473 1/20 0.35
DDAH1 O94760 1/20 0.35

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 SCHEMBL866931 1.00 NPY4R (0.44) NPY4RNPY1RDPP7NPY2RNPY5R
Hydrochloric Acid SCHEMBL29027297 1.00 NPY4R (0.44) NPY4RNPY1RDPP7NPY2RNPY5R
Hydrochloric Acid SCHEMBL940540 1.00 NPY4R (0.44) NPY4RNPY1RDPP7NPY2RNPY5R
Hydrochloric Acid SCHEMBL14840576 1.00 NPY4R (0.44) NPY4RNPY1RDPP7NPY2RNPY5R
Hydrochloric Acid SCHEMBL940539 1.00 NPY4R (0.44) NPY4RNPY1RDPP7NPY2RNPY5R
SCHEMBL42488 0.98 NPY4R (0.45) NPY4RNPY1RDPP7NPY2RNPY5R
SCHEMBL2172217 0.98 NPY4R (0.45) NPY4RNPY1RDPP7NPY2RNPY5R
SCHEMBL157856 0.98 NPY4R (0.45) NPY4RNPY1RDPP7NPY2RNPY5R
Guanidine SCHEMBL8907224 0.97 NPY4R (0.44) NPY4RNPY1RDPP7NPY2RNPY5R
SCHEMBL2236129 0.97 NPY4R (0.44) NPY4RNPY1RDPP7NPY2RNPY5R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116199836-A Block polymer material, preparation method and application thereof, and nano drug delivery system 中山大学附属第七医院(深圳) 2023-06-02 CN claimed
CN-106178988-B A kind of polyvinylidene fluoride blending film of photosynthesis-carbon dioxide response and preparation method thereof 台州学院 2019-09-24 CN claimed
WO-2002098824-A2 IMPROVEMENTS IN ENZYME STABILITY UNISEARCH LIMITED (AU) 2002-12-12 WO claimed
CN-115650894-B Amphoteric calixarene derivative, composite catalyst containing amphoteric calixarene derivative and application of amphoteric calixarene derivative 北京旭阳科技有限公司 2024-04-23 CN disclosed
CN-117800861-A Amino acid and derivative ionic liquid thereof, and preparation method and application thereof 中国药科大学 2024-04-02 CN disclosed
WO-2023130150-A2 SYSTEMS, CELL LINES AND METHODS OF PRODUCING AND USING THE SAME THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-07-06 WO disclosed
CN-116199836-A Block polymer material, preparation method and application thereof, and nano drug delivery system 中山大学附属第七医院(深圳) 2023-06-02 CN disclosed
CN-115650894-A Amphoteric calixarene derivative, composite catalyst containing amphoteric calixarene derivative and application of composite catalyst 北京旭阳科技有限公司 2023-01-31 CN disclosed
CN-113265050-B Degradable high polymer material, self-assembled nano composite and application 浙江大学 2022-08-23 CN disclosed
EP-3823530-A1 SYSTEMS AND METHODS FOR MEASURING LIVER ENZYME LEVELS IN BLOOD Nova Biomedical Corporation (US) 2021-05-26 EP disclosed
CN-111567541-B Preparation method and application of nano pesticide for conduction of plant phloem 华南农业大学 2021-05-07 CN disclosed
US-20050107305-A1 Novel chromogenic substances and use thereof for the determination of carboxypeptidase activities SOCIETE DIAGNOSTICA-STAGO (FR) 2005-05-19 US disclosed
CN-1524087-A Novel chromogenic substances and use thereof for the determination of carboxypeptidase activities 2004-08-25 CN disclosed
WO-2003056001-A1 MODIFIED ENZYMES AND MODIFICATION PROCESSES UNISEARCH (AU) 2003-07-10 WO disclosed
WO-1999043345-A1 AMINO ACID DEGRADING ENZYMES MODULATE CELL DEATH EISAI CO., LTD. (JP) 1999-09-02 WO disclosed
EP-0506468-B1 N-substituted 4-phenyl-piperidine opioid-antagonists LILLY CO ELI (US) 1995-04-26 EP disclosed
US-5270328-A Peripherally selective piperidine opioid antagonists ELI LILLY AND COMPANY (US) 1993-12-14 US disclosed
US-5159081-A INTERMEDIATES OF PERIPHERALLY SELECTIVE N-CARBONYL-3,4,4-TRISUBSTITUTED PIPERIDINE OPIOID ANTAGONISTS ELI LILLY AND COMPANY (US) 1992-10-27 US disclosed
EP-0506468-A1 N-substituted 4-phenyl-piperidine opioid-antagonists ELI LILLY AND COMPANY (US) 1992-09-30 EP disclosed
US-4568725-A POLYMERS MODIFIED SULFONATE DERIVATIVES AND SULFONATED ARGININE DERIVATIVES COMMISSARIAT A L'ENERGIE ATOMIQUE (FR) 1986-02-04 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 (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-20050107305-A1 Novel chromogenic substances and use thereof for the determination of carboxypeptidase activities CPA3, CPA4, CPA1 RRM1 2186/4885NPY4R 412/4885NPY1R 425/4885

“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.