Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5706355

CC[C@H](C)[C@H](N)C(=O)C1NCCS1.Cl

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 5)

geneUniProtsupporting neighboursconfidence
DPP4 known ✓ P27487 16/20 0.40
DPP8 Q6V1X1 7/20 0.39
DPP9 Q86TI2 7/20 0.39
DPP7 Q9UHL4 5/20 0.39
FAP Q12884 2/20 0.33

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 SCHEMBL5079153 1.00 DPP4 (0.40) DPP4DPP8DPP9DPP7FAP
Hydrochloric Acid SCHEMBL27529254 1.00 DPP4 (0.40) DPP4DPP8DPP9DPP7FAP
SCHEMBL353690 0.98 DPP4 (0.41) DPP4DPP8DPP9DPP7FAP
SCHEMBL1445688 0.98 DPP4 (0.41) DPP4DPP8DPP9DPP7FAP
SCHEMBL354706 0.98 DPP4 (0.41) DPP4DPP8DPP9DPP7FAP
Fumaric Acid SCHEMBL4955812 0.90 DPP4 (0.36) DPP4DPP8DPP9DPP7FAP
Fumaric Acid SCHEMBL4948911 0.90 DPP4 (0.36) DPP4DPP8DPP9DPP7FAP
Fumaric Acid SCHEMBL27529255 0.90 DPP4 (0.36) DPP4DPP8DPP9DPP7FAP
SCHEMBL27755779 0.86 DPP4 (0.49) DPP4DPP8DPP9DPP7FAP
SCHEMBL7056083 0.83 DPP4 (0.35) DPP4DPP8DPP9DPP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1332954-C Effector of dipeptidyl peptidase IV PROBIODRUG GES FUER ARZNEIM (GB) 2007-08-22 CN disclosed
EP-1398030-B1 Dipeptidyl peptidase IV effectors PROSIDION LTD (GB) 2006-09-06 EP disclosed
EP-1428533-B1 Use of thiazolidine-derivatives as antihyperglycemic agents PROSIDION LTD (GB) 2006-08-16 EP disclosed
CN-1637018-A Novel effectors of dipeptidyl peptidase IV PROSIDION LTD (GB) 2005-07-13 CN disclosed
EP-1304327-B1 Glutamine-thiazolidide and -pyrrolidide and their use as dipeptidylpeptidase IV inhibitors PROSIDION LTD (GB) 2005-02-23 EP disclosed
EP-1215207-B1 Organic Salts of isoleucyl-thiazolidine and -pyrrolidine and their use as dipeptidylpeptidase inhibitors PROBIODRUG AG (DE) 2004-07-28 EP disclosed
EP-1214936-B1 Use of thiazolidin- or pyrrolidin-derivatives of aminoacids as antihyperglycemic agents PROBIODRUG AG (DE) 2004-07-28 EP disclosed
EP-1428533-A2 Use of thiazolidine- or pyrrolidine-derivatives of aminoacids as antihyperglycemic agents Probiodrug AG (DE) 2004-06-16 EP disclosed
EP-1398030-A2 Dipeptidyl peptidase IV effectors Probiodrug AG (DE) 2004-03-17 EP disclosed
EP-1082314-B1 NEW DIPEPTIDYL PEPTIDASE IV EFFECTORS PROBIODRUG AG (DE) 2003-04-23 EP disclosed
EP-1304327-A2 Glutamine-thiazolidide and -pyrrolidide and their use as dipeptidylpeptidase IV inhibitors Probiodrug AG (DE) 2003-04-23 EP disclosed
EP-1215207-A2 Salts of isoleucyl-thiazolidine and -pyrrolidine and their use as dipeptidylpeptidase inhibitors Probiodrug AG (DE) 2002-06-19 EP disclosed
EP-1214936-A2 Use of thiazolidin- or pyrrolidin-derivatives of aminoacids as antihyperglycemic agents Probiodrug AG (DE) 2002-06-19 EP disclosed
CN-1303381-A Novel effectors of dipeptidyl peptidase IV PROBIODRUG GES FUER ARZNEIM (DE) 2001-07-11 CN disclosed