Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3676282

Cl.NC(=O)CCC(N)C(=O)C1NCCS1

nearest known ligand 0.41

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
DPP4 known ✓ P27487 1/20 0.32
KMT2A Q03164 2/20 0.41
ALOX15 P16050 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
DPP8 Q6V1X1 1/20 0.32
DPP9 Q86TI2 1/20 0.32
TARDBP Q13148 1/20 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 SCHEMBL3676279 1.00 KMT2A (0.41) KMT2AALOX15BLMPMP22DPP4
SCHEMBL1509587 0.98 KMT2A (0.42) KMT2AALOX15BLMPMP22DPP4
SCHEMBL1509586 0.98 KMT2A (0.42) KMT2AALOX15BLMPMP22DPP4
SCHEMBL4952904 0.86 GRM8 (0.43) BLMDPP4DPP8DPP9
SCHEMBL4952914 0.86 GRM8 (0.43) BLMDPP4DPP8DPP9
SCHEMBL6753730 0.79 GSR (0.43) DPP4DPP8DPP9
SCHEMBL902368 0.78 PTGS1 (0.36)
SCHEMBL27662491 0.74 ALOX15 (0.39) KMT2AALOX15BLMPMP22DPP4
Hydrochloric Acid SCHEMBL6098929 0.70
Hydrochloric Acid SCHEMBL5706355 0.70 DPP4 (0.40) DPP4DPP8DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100216800-A1 Treatment of Type 2 Diabetes With a Combination of DPIV Inhibitor and Metformin or Thiazolidinedione ROYALTY PHARMA FINANCE TRUST 2010-08-26 US claimed
US-20090186818-A1 Therapeutic Method for Glycaemic Control PROSIDION LIMITED (GB) 2009-07-23 US claimed
EP-2010217-A2 THERAPEUTIC METHOD FOR GLYCAEMIC CONTROL Prosidion Limited (GB) 2009-01-07 EP claimed
EP-1965783-A1 TREATMENT OF TYPE 2 DIABETES WITH A COMBINATION OF DPIV INHIBITOR AND METFORMIN OR THIAZOLIDINEDIONE Prosidion Limited (GB) 2008-09-10 EP claimed
WO-2007122419-A2 THERAPEUTIC METHOD FOR GLYCAEMIC CONTROL PROSIDION LIMITED (GB) 2007-11-01 WO claimed
WO-2007072083-A1 TREATMENT OF TYPE 2 DIABETES WITH A COMBINATION OF DPIV INHIBITOR AND METFORMIN OR THIAZOLIDINEDIONE PROSIDION LIMITED (GB) 2007-06-28 WO claimed
US-20060287251-A1 Combination therapy for glycaemic control DEMUTH HANS-ULRICH 2006-12-21 US claimed
EP-1695970-A1 Peptides useful for competitive modulation of dipeptidyl peptidase IV catalysis Prosidion Limited (GB) 2006-08-30 EP claimed
EP-1663200-A2 COMBINATION THERAPY FOR GLYCAEMIC CONTROL Prosidion Limited (GB) 2006-06-07 EP claimed
WO-2005020983-A2 COMBINATION THERAPY FOR GLYCAEMIC CONTROL PROSIDION LTD. (GB) 2005-03-10 WO claimed
EP-1399471-B1 USE OF DIPEPTIDYL PEPTIDASE IV INHIBITORS AS THERAPEUTICS FOR NEUROLOGICAL DISORDERS PROBIODRUG AG (DE) 2008-01-30 EP disclosed
CN-1321682-C New dipeptidyl peptidase iv inhibitors and their uses as anti-cancer agents PROBIODRUG AG (DE) 2007-06-20 CN disclosed
EP-1480961-B1 GLUTAMINYL BASED DPIV INHIBITORS PROSIDION LTD (GB) 2006-12-27 EP disclosed
US-20060287251-A1 Combination therapy for glycaemic control DEMUTH HANS-ULRICH 2006-12-21 US disclosed
EP-1695970-A1 Peptides useful for competitive modulation of dipeptidyl peptidase IV catalysis Prosidion Limited (GB) 2006-08-30 EP disclosed
WO-2003072556-A1 GLUTAMINYL BASED DPIV INHIBITORS PROSIDION LTD. (GB) 2003-09-04 WO disclosed
US-20030130199-A1 Dipeptidyl peptidase IV inhibitors and their uses as anti-cancer agents PROBIODRUG (DE) 2003-07-10 US disclosed
WO-2003015775-A1 NEW DIPEPTIDYL PEPTIDASE IV INHIBITORS AND THEIR USES FOR LOWERING BLOOD PRESSURE LEVELS PROBIODRUG AG (DE) 2003-02-27 WO disclosed
WO-2003002596-A2 USE OF DIPEPTIDYL PEPTIDASE IV INHIBITORS AS THERAPEUTICS FOR NEUROLOGICAL DISORDERS PROBIODRUG AG (DE) 2003-01-09 WO disclosed
WO-2003002595-A2 DIPEPTIDYL PEPTIDASE IV INHIBITORS AND THEIR USES AS ANTI-CANCER AGENTS PROBIODRUG AG (DE) 2003-01-09 WO 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-20060287251-A1 Combination therapy for glycaemic control IAPP, SLC5A2, GCG DPP4 16/4885KMT2A 2983/4885ALOX15 2662/4885
US-20030130199-A1 Dipeptidyl peptidase IV inhibitors and their uses as anti-cancer agents DPP4, DPP3, DNPEP DPP4 1/4885KMT2A 2238/4885ALOX15 4009/4885

“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.